3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide

C16H19N3O — CID 63141954

IUPAC3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)Nc2ccc3ncccc3c2)CCNC1
InChIInChI=1S/C16H19N3O/c1-2-16(7-9-17-11-16)15(20)19-13-5-6-14-12(10-13)4-3-8-18-14/h3-6,8,10,17H,2,7,9,11H2,1H3,(H,19,20)
InChIKeyGWWHSNJSWUHBJP-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.56
Rot. Bonds3

About 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide

3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide (PubChem CID 63141954) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide
PubChem CID63141954
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)Nc2ccc3ncccc3c2)CCNC1
InChIInChI=1S/C16H19N3O/c1-2-16(7-9-17-11-16)15(20)19-13-5-6-14-12(10-13)4-3-8-18-14/h3-6,8,10,17H,2,7,9,11H2,1H3,(H,19,20)
InChIKeyGWWHSNJSWUHBJP-UHFFFAOYSA-N
XLogP2.56
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide
CID 63140174
3-ethyl-N-quinolin-3-ylpyrrolidine-3-carboxamide
CID 63139330
(3S)-3-ethyl-N-(1H-indazol-5-yl)pyrrolidine-3-carboxamide
CID 95018921
3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide
CID 55165902
4-pyrazol-1-yl-N-quinolin-6-ylpiperidine-4-carboxamide;dihydrochloride
CID 120938699
N-(4-bromo-3-methylphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140591
3-ethyl-N-(3-fluoro-4-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 64782595
N-(4-ethoxyphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140867
3-ethyl-N-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 63140483
3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
CID 55166292
3-[(3-ethylpiperidine-3-carbonyl)amino]benzoic acid
CID 63131356
5-[(3-ethylpyrrolidine-3-carbonyl)amino]-2-fluorobenzoic acid
CID 63139894

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide (CID 63141954) is 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide is CCC1(C(=O)Nc2ccc3ncccc3c2)CCNC1.
What is the InChIKey of 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide?
The InChIKey is GWWHSNJSWUHBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-2-16(7-9-17-11-16)15(20)19-13-5-6-14-12(10-13)4-3-8-18-14/h3-6,8,10,17H,2,7,9,11H2,1H3,(H,19,20).
What are the key properties of 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide?
3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63141954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).