6-methyl-9H-pyrido[3,4-b]indol-3-amine

C12H11N3 — CID 115021046

IUPAC6-methyl-9H-pyrido[3,4-b]indol-3-amine
SMILESCc1ccc2[nH]c3cnc(N)cc3c2c1
InChIInChI=1S/C12H11N3/c1-7-2-3-10-8(4-7)9-5-12(13)14-6-11(9)15-10/h2-6,15H,1H3,(H2,13,14)
InChIKeyVPHDSQVFQSYFTC-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.61
Rot. Bonds

About 6-methyl-9H-pyrido[3,4-b]indol-3-amine

6-methyl-9H-pyrido[3,4-b]indol-3-amine (PubChem CID 115021046) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 6-methyl-9H-pyrido[3,4-b]indol-3-amine.

Molecular Properties

Compound Name6-methyl-9H-pyrido[3,4-b]indol-3-amine
PubChem CID115021046
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name6-methyl-9H-pyrido[3,4-b]indol-3-amine
SMILESCc1ccc2[nH]c3cnc(N)cc3c2c1
InChIInChI=1S/C12H11N3/c1-7-2-3-10-8(4-7)9-5-12(13)14-6-11(9)15-10/h2-6,15H,1H3,(H2,13,14)
InChIKeyVPHDSQVFQSYFTC-UHFFFAOYSA-N
XLogP2.61
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-dimethyl-9H-carbazole
CID 144942624
3-amino-9H-pyrido[3,4-b]indole-6-carbaldehyde
CID 23559431
8-methyl-5,11-dihydroindolo[3,2-b]carbazol-2-amine
CID 123384681
7-bromo-9H-pyrido[3,4-b]indol-3-amine
CID 115048933
7-chloro-9H-pyrido[3,4-b]indol-3-amine
CID 115030362
6-methyl-1-propan-2-yl-9H-pyrido[3,4-b]indol-3-amine
CID 115043154
2,7-dimethyl-10H-acridin-9-one
CID 13293445
7-methylisoquinolin-3-amine
CID 122198375
4-amino-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-12-ol
CID 70942309
6-methyl-9H-carbazol-2-ol
CID 91665228
12-(4-ethylphenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-amine
CID 70942423
1,3,6-trimethyl-9H-carbazole
CID 139213984

Frequently Asked Questions

What is the IUPAC name of 6-methyl-9H-pyrido[3,4-b]indol-3-amine?
The IUPAC name of 6-methyl-9H-pyrido[3,4-b]indol-3-amine (CID 115021046) is 6-methyl-9H-pyrido[3,4-b]indol-3-amine.
What is the SMILES notation for 6-methyl-9H-pyrido[3,4-b]indol-3-amine?
The canonical SMILES for 6-methyl-9H-pyrido[3,4-b]indol-3-amine is Cc1ccc2[nH]c3cnc(N)cc3c2c1.
What is the InChIKey of 6-methyl-9H-pyrido[3,4-b]indol-3-amine?
The InChIKey is VPHDSQVFQSYFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-7-2-3-10-8(4-7)9-5-12(13)14-6-11(9)15-10/h2-6,15H,1H3,(H2,13,14).
What are the key properties of 6-methyl-9H-pyrido[3,4-b]indol-3-amine?
6-methyl-9H-pyrido[3,4-b]indol-3-amine has a molecular weight of 197.24 g/mol, XLogP of 2.61, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-9H-pyrido[3,4-b]indol-3-amine is sourced from PubChem (CID 115021046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).