N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide

C13H17NO3 — CID 110389813

IUPACN-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide
SMILESO=C(CCC(=O)c1ccco1)NC1CCCC1
InChIInChI=1S/C13H17NO3/c15-11(12-6-3-9-17-12)7-8-13(16)14-10-4-1-2-5-10/h3,6,9-10H,1-2,4-5,7-8H2,(H,14,16)
InChIKeyXUYMXEIBULCTEN-UHFFFAOYSA-N
MW235.28 g/mol
LogP2.30
Rot. Bonds5

About N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide

N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide (PubChem CID 110389813) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide
PubChem CID110389813
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC NameN-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide
SMILESO=C(CCC(=O)c1ccco1)NC1CCCC1
InChIInChI=1S/C13H17NO3/c15-11(12-6-3-9-17-12)7-8-13(16)14-10-4-1-2-5-10/h3,6,9-10H,1-2,4-5,7-8H2,(H,14,16)
InChIKeyXUYMXEIBULCTEN-UHFFFAOYSA-N
XLogP2.30
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclooctylfuran-2-carboxamide
CID 790432
N-cyclopentyl-2-(furan-2-yl)acetamide
CID 110690587
N-[[4-(cycloheptylamino)-4-oxobutan-2-ylidene]amino]furan-2-carboxamide
CID 4307620
N-[3-[(4-hydroxycyclohexyl)amino]-3-oxopropyl]furan-2-carboxamide
CID 43389127
4-(2,3-dihydro-1H-inden-5-yl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-oxobutanamide
CID 46510369
4-(4-ethoxyphenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-oxobutanamide
CID 16613595
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876
N-[2-(cyclohexylamino)-2-oxoethyl]-N-(2-methylphenyl)furan-2-carboxamide
CID 3228296
[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
CID 7880332
methyl 4-[[1-(furan-2-carbonyl)piperidin-4-yl]amino]-4-oxobutanoate
CID 110820105
N-[3-[(4-methylcyclohexyl)amino]-3-oxopropyl]furan-2-carboxamide
CID 24633715
N-cyclopentyl-2-(furan-2-ylmethylamino)acetamide
CID 28586516

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide?
The IUPAC name of N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide (CID 110389813) is N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide.
What is the SMILES notation for N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide?
The canonical SMILES for N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide is O=C(CCC(=O)c1ccco1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide?
The InChIKey is XUYMXEIBULCTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c15-11(12-6-3-9-17-12)7-8-13(16)14-10-4-1-2-5-10/h3,6,9-10H,1-2,4-5,7-8H2,(H,14,16).
What are the key properties of N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide?
N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide has a molecular weight of 235.28 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide is sourced from PubChem (CID 110389813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).