N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide

C15H17N3O2 — CID 6484351

IUPACN-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide
SMILESCc1cccc2c(=O)c(NC(=O)N3CCCC3)c[nH]c12
InChIInChI=1S/C15H17N3O2/c1-10-5-4-6-11-13(10)16-9-12(14(11)19)17-15(20)18-7-2-3-8-18/h4-6,9H,2-3,7-8H2,1H3,(H,16,19)(H,17,20)
InChIKeyPXUVXNAYJVXRFG-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.46
Rot. Bonds1

About N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide

N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide (PubChem CID 6484351) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide
PubChem CID6484351
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide
SMILESCc1cccc2c(=O)c(NC(=O)N3CCCC3)c[nH]c12
InChIInChI=1S/C15H17N3O2/c1-10-5-4-6-11-13(10)16-9-12(14(11)19)17-15(20)18-7-2-3-8-18/h4-6,9H,2-3,7-8H2,1H3,(H,16,19)(H,17,20)
InChIKeyPXUVXNAYJVXRFG-UHFFFAOYSA-N
XLogP2.46
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1-carboxamide
CID 6490336
1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide
CID 23607647
tert-butyl 4-[(8-methyl-4-oxo-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylate
CID 6490345
N-(1H-indol-3-yl)pyrrolidine-1-carboxamide
CID 7615879
N-(2-methylphenyl)azepane-1-carboxamide
CID 19165583
N-(3-hydroxy-2-methylphenyl)piperidine-1-carboxamide
CID 79155888
N-(2-methylquinolin-4-yl)azepane-1-carboxamide
CID 115882563
1-[2-(7-methyl-1H-indol-3-yl)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 122003471
N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(2-oxo-2-pyrrolidin-1-ylacetyl)piperazine-1-carboxamide
CID 56553422
N-(1H-indol-3-yl)-4-methylpiperazine-1-carboxamide
CID 7615909
1-methyl-N-[2-(pyrrolidine-1-carbonylamino)phenyl]indole-3-carboxamide
CID 55736422
N-(2-methyl-6-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-1-carboxamide
CID 166228625

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide (CID 6484351) is N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide is Cc1cccc2c(=O)c(NC(=O)N3CCCC3)c[nH]c12.
What is the InChIKey of N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is PXUVXNAYJVXRFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-5-4-6-11-13(10)16-9-12(14(11)19)17-15(20)18-7-2-3-8-18/h4-6,9H,2-3,7-8H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide?
N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 6484351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).