2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide

C14H13N3O — CID 68828123

IUPAC2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide
SMILESCc1cc2c(nc1C)[nH]c1c(C(N)=O)cccc12
InChIInChI=1S/C14H13N3O/c1-7-6-11-9-4-3-5-10(13(15)18)12(9)17-14(11)16-8(7)2/h3-6H,1-2H3,(H2,15,18)(H,16,17)
InChIKeyFPPYOCSBGYTRIB-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.43
Rot. Bonds1

About 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide

2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide (PubChem CID 68828123) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide
PubChem CID68828123
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide
SMILESCc1cc2c(nc1C)[nH]c1c(C(N)=O)cccc12
InChIInChI=1S/C14H13N3O/c1-7-6-11-9-4-3-5-10(13(15)18)12(9)17-14(11)16-8(7)2/h3-6H,1-2H3,(H2,15,18)(H,16,17)
InChIKeyFPPYOCSBGYTRIB-UHFFFAOYSA-N
XLogP2.43
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide?
The IUPAC name of 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide (CID 68828123) is 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide.
What is the SMILES notation for 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide?
The canonical SMILES for 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide is Cc1cc2c(nc1C)[nH]c1c(C(N)=O)cccc12.
What is the InChIKey of 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide?
The InChIKey is FPPYOCSBGYTRIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-7-6-11-9-4-3-5-10(13(15)18)12(9)17-14(11)16-8(7)2/h3-6H,1-2H3,(H2,15,18)(H,16,17).
What are the key properties of 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide?
2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide has a molecular weight of 239.28 g/mol, XLogP of 2.43, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-9H-pyrido[2,3-b]indole-8-carboxamide is sourced from PubChem (CID 68828123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).