1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide

C17H20N4O3 — CID 23607647

IUPAC1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide
SMILESCc1cccc2c(=O)c(NC(=O)N3CCC(C(N)=O)CC3)c[nH]c12
InChIInChI=1S/C17H20N4O3/c1-10-3-2-4-12-14(10)19-9-13(15(12)22)20-17(24)21-7-5-11(6-8-21)16(18)23/h2-4,9,11H,5-8H2,1H3,(H2,18,23)(H,19,22)(H,20,24)
InChIKeyGPLOKCGGTVJAPH-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.57
Rot. Bonds2

About 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide

1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide (PubChem CID 23607647) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide
PubChem CID23607647
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide
SMILESCc1cccc2c(=O)c(NC(=O)N3CCC(C(N)=O)CC3)c[nH]c12
InChIInChI=1S/C17H20N4O3/c1-10-3-2-4-12-14(10)19-9-13(15(12)22)20-17(24)21-7-5-11(6-8-21)16(18)23/h2-4,9,11H,5-8H2,1H3,(H2,18,23)(H,19,22)(H,20,24)
InChIKeyGPLOKCGGTVJAPH-UHFFFAOYSA-N
XLogP1.57
TPSA108.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide
CID 6484351
3-hydroxy-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1-carboxamide
CID 6490336
tert-butyl 4-[(8-methyl-4-oxo-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylate
CID 6490345
1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
CID 16645831
1-[2-[(2-iodo-3-methylbenzoyl)amino]benzoyl]piperidine-4-carboxamide
CID 60544520
3-(4-methoxyazepane-1-carbonyl)-8-methyl-1H-quinolin-4-one
CID 167789919
1-N-(2-methoxy-3-pyridinyl)piperidine-1,4-dicarboxamide
CID 47222931
1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide
CID 108893994
1-N-(2,5-dimethoxyphenyl)piperidine-1,4-dicarboxamide
CID 3830798
1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide
CID 108887466
1-[(2-cyano-3-methylphenyl)carbamoyl]piperidine-4-carboxylic acid
CID 107799995
1-N-[3-(1-hydroxyethyl)phenyl]piperidine-1,4-dicarboxamide
CID 61347794

Frequently Asked Questions

What is the IUPAC name of 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide (CID 23607647) is 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide is Cc1cccc2c(=O)c(NC(=O)N3CCC(C(N)=O)CC3)c[nH]c12.
What is the InChIKey of 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide?
The InChIKey is GPLOKCGGTVJAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-10-3-2-4-12-14(10)19-9-13(15(12)22)20-17(24)21-7-5-11(6-8-21)16(18)23/h2-4,9,11H,5-8H2,1H3,(H2,18,23)(H,19,22)(H,20,24).
What are the key properties of 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide?
1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide has a molecular weight of 328.37 g/mol, XLogP of 1.57, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(8-methyl-4-oxo-1H-quinolin-3-yl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 23607647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).