Free Chemical Databases
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[Synonyms]
[Structure]
[ Properties Computed from Structure]
Molecular Weight 296.40996 [g/mol] Molecular Formula C18H24N4 XLogP 3.4 H-Bond Donor 1 H-Bond Acceptor 4 Rotatable Bond Count 5 Tautomer Count 2 Exact Mass 296.200097 MonoIsotopic Mass 296.200097 Topological Polar Surface Area 33.1 Heavy Atom Count 22 Formal Charge 0 Complexity 359 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: N-(4,5-dimethylpyrido[4,3-b]indol-1-yl)-N',N'-dimethylpropane-1,
3-diamine
Canonical SMILES: CC1=CN=C(C2=C1N(C3=CC=CC=C32)C)NCCCN(C)C
InChI: InChI=1/C18H24N4/c1-13-12-20-18(19-10-7-11-21(2)3)16-14-8-5-6-9-15(14)22
(4)17(13)16/h5-6,8-9,12H,7,10-11H2,1-4H3,(H,19,20)/f/h19H
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