N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide

C15H22N2O3 — CID 75414137

IUPACN-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCC(CCc1ccco1)NC(=O)C1CCN(C)C(=O)C1
InChIInChI=1S/C15H22N2O3/c1-11(5-6-13-4-3-9-20-13)16-15(19)12-7-8-17(2)14(18)10-12/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,16,19)
InChIKeyGTJNJSVJROZQML-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.59
Rot. Bonds5

About N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide

N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide (PubChem CID 75414137) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide
PubChem CID75414137
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCC(CCc1ccco1)NC(=O)C1CCN(C)C(=O)C1
InChIInChI=1S/C15H22N2O3/c1-11(5-6-13-4-3-9-20-13)16-15(19)12-7-8-17(2)14(18)10-12/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,16,19)
InChIKeyGTJNJSVJROZQML-UHFFFAOYSA-N
XLogP1.59
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-2-oxo-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]piperidine-4-carboxamide
CID 51088386
N-[4-(furan-2-yl)butan-2-yl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 23609720
(3S)-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
CID 81141055
N-[(2R)-4-(furan-2-yl)butan-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 9141771
N-[4-(furan-2-yl)butan-2-yl]-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazoline-6-carboxamide
CID 53193910
N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide
CID 76896522
(3R)-1-[4-(furan-2-yl)butan-2-ylcarbamoyl]piperidine-3-carboxylic acid
CID 81128264
1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone
CID 43224097
(3S)-1-(furan-2-ylmethyl)-N-[(2S)-1-morpholin-4-ylpropan-2-yl]-5-oxopyrrolidine-3-carboxamide
CID 94116635
(3S,4S)-N-[4-(furan-2-yl)butan-2-yl]-4-methylpyrrolidine-3-carboxamide
CID 114084833
4-[(1-methyl-2-oxopiperidine-4-carbonyl)amino]-4-phenylbutanoic acid
CID 119201075
N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide
CID 32598215

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide?
The IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide (CID 75414137) is N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide.
What is the SMILES notation for N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide?
The canonical SMILES for N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide is CC(CCc1ccco1)NC(=O)C1CCN(C)C(=O)C1.
What is the InChIKey of N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide?
The InChIKey is GTJNJSVJROZQML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-11(5-6-13-4-3-9-20-13)16-15(19)12-7-8-17(2)14(18)10-12/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,16,19).
What are the key properties of N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide?
N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)butan-2-yl]-1-methyl-2-oxopiperidine-4-carboxamide is sourced from PubChem (CID 75414137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).