N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide

C18H19N3O2 — CID 97407824

IUPACN-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide
SMILESCOc1cc(C(=O)N[C@H]2c3ccccc3[C@@H]3CNC[C@@H]32)ccn1
InChIInChI=1S/C18H19N3O2/c1-23-16-8-11(6-7-20-16)18(22)21-17-13-5-3-2-4-12(13)14-9-19-10-15(14)17/h2-8,14-15,17,19H,9-10H2,1H3,(H,21,22)/t14-,15-,17-/m0/s1
InChIKeyJMRAULSLSINWKU-ZOBUZTSGSA-N
MW309.37 g/mol
LogP1.88
Rot. Bonds3

About N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide

N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide (PubChem CID 97407824) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide
PubChem CID97407824
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide
SMILESCOc1cc(C(=O)N[C@H]2c3ccccc3[C@@H]3CNC[C@@H]32)ccn1
InChIInChI=1S/C18H19N3O2/c1-23-16-8-11(6-7-20-16)18(22)21-17-13-5-3-2-4-12(13)14-9-19-10-15(14)17/h2-8,14-15,17,19H,9-10H2,1H3,(H,21,22)/t14-,15-,17-/m0/s1
InChIKeyJMRAULSLSINWKU-ZOBUZTSGSA-N
XLogP1.88
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

acetic acid;2-methoxy-N-[(3S,4S)-4-methoxypyrrolidin-3-yl]pyridine-4-carboxamide
CID 154910821
N-cyclohexyl-2-methoxypyridine-4-carboxamide
CID 110848962
2-methoxy-N-(2-methylcyclohexyl)pyridine-4-carboxamide
CID 59355726
2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
CID 84580463
2-[(2-methoxypyridine-4-carbonyl)amino]acetic acid
CID 170946630
2-methoxy-N-[2-(1H-pyrazol-5-yl)phenyl]pyridine-4-carboxamide
CID 166368624
N-methoxy-2-phenylmethoxypyridine-4-carboxamide
CID 47366546
2-methoxy-N-pyridin-3-ylpyridine-4-carboxamide
CID 84580431
2-methoxy-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-4-carboxamide
CID 122568384
N-[4-[2-(cyclopropylamino)-2-oxoethyl]phenyl]-2-methoxypyridine-4-carboxamide
CID 131925834
N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide
CID 110857659
N-(2,4-dimethoxyphenyl)-2-methoxypyridine-4-carboxamide
CID 84580517

Frequently Asked Questions

What is the IUPAC name of N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide?
The IUPAC name of N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide (CID 97407824) is N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide?
The canonical SMILES for N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide is COc1cc(C(=O)N[C@H]2c3ccccc3[C@@H]3CNC[C@@H]32)ccn1.
What is the InChIKey of N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide?
The InChIKey is JMRAULSLSINWKU-ZOBUZTSGSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-23-16-8-11(6-7-20-16)18(22)21-17-13-5-3-2-4-12(13)14-9-19-10-15(14)17/h2-8,14-15,17,19H,9-10H2,1H3,(H,21,22)/t14-,15-,17-/m0/s1.
What are the key properties of N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide?
N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3aR,4R,8bR)-1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrrol-4-yl]-2-methoxypyridine-4-carboxamide is sourced from PubChem (CID 97407824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).