4-(3-oxocyclopentyl)oxybenzamide

C12H13NO3 — CID 79644045

IUPAC4-(3-oxocyclopentyl)oxybenzamide
SMILESNC(=O)c1ccc(OC2CCC(=O)C2)cc1
InChIInChI=1S/C12H13NO3/c13-12(15)8-1-4-10(5-2-8)16-11-6-3-9(14)7-11/h1-2,4-5,11H,3,6-7H2,(H2,13,15)
InChIKeyQCEPATRMTPMOAE-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.29
Rot. Bonds3

About 4-(3-oxocyclopentyl)oxybenzamide

4-(3-oxocyclopentyl)oxybenzamide (PubChem CID 79644045) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is 4-(3-oxocyclopentyl)oxybenzamide.

Molecular Properties

Compound Name4-(3-oxocyclopentyl)oxybenzamide
PubChem CID79644045
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name4-(3-oxocyclopentyl)oxybenzamide
SMILESNC(=O)c1ccc(OC2CCC(=O)C2)cc1
InChIInChI=1S/C12H13NO3/c13-12(15)8-1-4-10(5-2-8)16-11-6-3-9(14)7-11/h1-2,4-5,11H,3,6-7H2,(H2,13,15)
InChIKeyQCEPATRMTPMOAE-UHFFFAOYSA-N
XLogP1.29
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-oxocyclohexyl)oxybenzamide
CID 18445301
4-cycloheptyloxybenzamide
CID 141109251
4-(3-oxocyclopentyl)oxy-3-(trifluoromethyl)benzamide
CID 115468230
3-nitro-4-(3-oxocyclopentyl)oxybenzamide
CID 79643110
4-[(3R)-piperidin-3-yl]oxybenzamide
CID 42553466
4-[4-(3-oxocyclopentyl)oxyphenyl]benzonitrile
CID 79639113
4-(4-hydroxyphenoxy)cyclohexan-1-one
CID 18359489
4-(4-chlorophenoxy)cyclohexan-1-one
CID 58923771
4-(4-methoxyphenoxy)cyclohexan-1-one
CID 22467175
4-(4-carbamoylphenoxy)benzamide
CID 156597124
3-(3-ethoxyphenoxy)cyclopentan-1-one
CID 79643582
(1-aminocyclopropyl)-(4-cyclopropyloxyphenyl)methanone
CID 114520626

Frequently Asked Questions

What is the IUPAC name of 4-(3-oxocyclopentyl)oxybenzamide?
The IUPAC name of 4-(3-oxocyclopentyl)oxybenzamide (CID 79644045) is 4-(3-oxocyclopentyl)oxybenzamide.
What is the SMILES notation for 4-(3-oxocyclopentyl)oxybenzamide?
The canonical SMILES for 4-(3-oxocyclopentyl)oxybenzamide is NC(=O)c1ccc(OC2CCC(=O)C2)cc1.
What is the InChIKey of 4-(3-oxocyclopentyl)oxybenzamide?
The InChIKey is QCEPATRMTPMOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c13-12(15)8-1-4-10(5-2-8)16-11-6-3-9(14)7-11/h1-2,4-5,11H,3,6-7H2,(H2,13,15).
What are the key properties of 4-(3-oxocyclopentyl)oxybenzamide?
4-(3-oxocyclopentyl)oxybenzamide has a molecular weight of 219.24 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-oxocyclopentyl)oxybenzamide is sourced from PubChem (CID 79644045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).