N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide

C19H21N3O2 — CID 53137966

IUPACN-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide
SMILESCc1ccc2c(C(=O)N3CCCC3)cc(NC(=O)C3CC3)cc2n1
InChIInChI=1S/C19H21N3O2/c1-12-4-7-15-16(19(24)22-8-2-3-9-22)10-14(11-17(15)20-12)21-18(23)13-5-6-13/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3,(H,21,23)
InChIKeyKVPYTKHLZPDGHT-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.13
Rot. Bonds3

About N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide

N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide (PubChem CID 53137966) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide
PubChem CID53137966
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide
SMILESCc1ccc2c(C(=O)N3CCCC3)cc(NC(=O)C3CC3)cc2n1
InChIInChI=1S/C19H21N3O2/c1-12-4-7-15-16(19(24)22-8-2-3-9-22)10-14(11-17(15)20-12)21-18(23)13-5-6-13/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3,(H,21,23)
InChIKeyKVPYTKHLZPDGHT-UHFFFAOYSA-N
XLogP3.13
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(azepane-1-carbonyl)-2-methylquinolin-7-yl]cyclopropanecarboxamide
CID 53137967
7-(cyclobutanecarbonylamino)-2-methylquinoline-5-carboxylic acid
CID 90488075
7-(cyclobutanecarbonylamino)-2-methyl-N-(2-methylpropyl)quinoline-5-carboxamide
CID 53137977
7-(cyclobutanecarbonylamino)-2-methyl-N-(2-thiophen-2-ylethyl)quinoline-5-carboxamide
CID 53137983
N-[3-(piperidine-1-carbonyl)-4-pyrrolidin-1-ylphenyl]cyclopropanecarboxamide
CID 42751185
azepan-1-yl-(2,6-dimethyl-3-pyridinyl)methanone
CID 60924601
N-[2-[3-hydroxy-1-methyl-4-(pyrrolidine-1-carbonyl)pyrrol-2-yl]-1-methylbenzimidazol-5-yl]cyclopropanecarboxamide
CID 135638530
N-[4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-methylquinolin-7-yl]cyclopropanecarboxamide
CID 91456633
N-[3-(azepan-1-yl)-4-(piperidine-1-carbonyl)phenyl]cyclopropanecarboxamide
CID 53146022
(7-bromo-2-methylquinolin-4-yl)-(4-hydroxypiperidin-1-yl)methanone
CID 110897019
(7-bromo-2-methylquinolin-4-yl)-[(3R)-3-(methylamino)piperidin-1-yl]methanone
CID 124575462
1-(2-methylquinoline-4-carbonyl)piperidine-4-carboxylic acid
CID 24698090

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide?
The IUPAC name of N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide (CID 53137966) is N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide is Cc1ccc2c(C(=O)N3CCCC3)cc(NC(=O)C3CC3)cc2n1.
What is the InChIKey of N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide?
The InChIKey is KVPYTKHLZPDGHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-12-4-7-15-16(19(24)22-8-2-3-9-22)10-14(11-17(15)20-12)21-18(23)13-5-6-13/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3,(H,21,23).
What are the key properties of N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide?
N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide has a molecular weight of 323.40 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-(pyrrolidine-1-carbonyl)quinolin-7-yl]cyclopropanecarboxamide is sourced from PubChem (CID 53137966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).