N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide

C17H16N4O — CID 112526280

IUPACN-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
SMILESO=C(Nc1cccc2[nH]ccc12)c1cncc2c1CCNC2
InChIInChI=1S/C17H16N4O/c22-17(14-10-19-9-11-8-18-6-4-12(11)14)21-16-3-1-2-15-13(16)5-7-20-15/h1-3,5,7,9-10,18,20H,4,6,8H2,(H,21,22)
InChIKeyGGURDSKJDSMLBG-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.46
Rot. Bonds2

About N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide

N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide (PubChem CID 112526280) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
PubChem CID112526280
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC NameN-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
SMILESO=C(Nc1cccc2[nH]ccc12)c1cncc2c1CCNC2
InChIInChI=1S/C17H16N4O/c22-17(14-10-19-9-11-8-18-6-4-12(11)14)21-16-3-1-2-15-13(16)5-7-20-15/h1-3,5,7,9-10,18,20H,4,6,8H2,(H,21,22)
InChIKeyGGURDSKJDSMLBG-UHFFFAOYSA-N
XLogP2.46
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indol-3-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112526913
N-isoquinolin-8-yl-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 167745801
N-methyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520529
N-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520892
2-fluoro-N-(1H-indol-4-yl)benzamide
CID 110730909
N-cyclohexyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520196
N-(1H-indol-4-yl)-1H-indole-7-carboxamide
CID 112526402
2-oxo-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)-1H-pyridine-4-carboxamide
CID 103806791
N-(2-methyl-1H-indol-5-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112526134
2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)furan-3-carboxamide
CID 80554325
2-N,2-N-dimethyl-5-N-(2-methyl-1H-indol-4-yl)-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
CID 112526494
N-pyridin-3-yl-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104557847

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
The IUPAC name of N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide (CID 112526280) is N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide.
What is the SMILES notation for N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
The canonical SMILES for N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide is O=C(Nc1cccc2[nH]ccc12)c1cncc2c1CCNC2.
What is the InChIKey of N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
The InChIKey is GGURDSKJDSMLBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c22-17(14-10-19-9-11-8-18-6-4-12(11)14)21-16-3-1-2-15-13(16)5-7-20-15/h1-3,5,7,9-10,18,20H,4,6,8H2,(H,21,22).
What are the key properties of N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.46, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide is sourced from PubChem (CID 112526280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).