4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide

C16H19N3O2 — CID 174465207

IUPAC4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide
SMILESCOC1CCCN1c1cc(C)nc2cc(C(N)=O)ccc12
InChIInChI=1S/C16H19N3O2/c1-10-8-14(19-7-3-4-15(19)21-2)12-6-5-11(16(17)20)9-13(12)18-10/h5-6,8-9,15H,3-4,7H2,1-2H3,(H2,17,20)
InChIKeyNHJCZUGHMVHDAC-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.21
Rot. Bonds3

About 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide

4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide (PubChem CID 174465207) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide.

Molecular Properties

Compound Name4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide
PubChem CID174465207
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide
SMILESCOC1CCCN1c1cc(C)nc2cc(C(N)=O)ccc12
InChIInChI=1S/C16H19N3O2/c1-10-8-14(19-7-3-4-15(19)21-2)12-6-5-11(16(17)20)9-13(12)18-10/h5-6,8-9,15H,3-4,7H2,1-2H3,(H2,17,20)
InChIKeyNHJCZUGHMVHDAC-UHFFFAOYSA-N
XLogP2.21
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methylquinoline-4-carboxamide
CID 85122
(2-Phenyl-quinolin-4-yl)-pyrrolidin-1-yl-methanone
CID 757669
N,N-dimethyl-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 705818
4-Quinolinecarboxamide,n-cyclopentyl-2-methyl-
CID 757639
N-(2,5-dimethylphenyl)-2-ethyl-3-methylquinoline-4-carboxamide
CID 856047
2-Methyl-quinoline-4-carboxylic acid (2,5-dimethyl-phenyl)-amide
CID 856133
N-butyl-2-methylquinoline-4-carboxamide
CID 2108581
[2-(4-Methylphenyl)quinolin-4-yl]-morpholin-4-ylmethanone
CID 847425
[2-(2-Methylphenyl)quinolin-4-yl]-pyrrolidin-1-ylmethanone
CID 896504
9-chloro-N-(3-pyrrolidin-1-ylpropyl)-5,6,7,8-tetrahydroacridine-3-carboxamide
CID 6619646
2-phenyl-N-(2-pyrrolidin-1-ylethyl)quinoline-4-carboxamide
CID 42749406
4-[(2,7-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)methyl]-N-hydroxybenzamide
CID 50898950

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide?
The IUPAC name of 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide (CID 174465207) is 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide.
What is the SMILES notation for 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide?
The canonical SMILES for 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide is COC1CCCN1c1cc(C)nc2cc(C(N)=O)ccc12.
What is the InChIKey of 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide?
The InChIKey is NHJCZUGHMVHDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10-8-14(19-7-3-4-15(19)21-2)12-6-5-11(16(17)20)9-13(12)18-10/h5-6,8-9,15H,3-4,7H2,1-2H3,(H2,17,20).
What are the key properties of 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide?
4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxypyrrolidin-1-yl)-2-methylquinoline-7-carboxamide is sourced from PubChem (CID 174465207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).