2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide

C15H19NO3 — CID 111538677

IUPAC2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide
SMILESCC(=O)c1ccccc1C(=O)NCC1(O)CCCC1
InChIInChI=1S/C15H19NO3/c1-11(17)12-6-2-3-7-13(12)14(18)16-10-15(19)8-4-5-9-15/h2-3,6-7,19H,4-5,8-10H2,1H3,(H,16,18)
InChIKeyFDISIVKUKXYPJE-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.92
Rot. Bonds4

About 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide

2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide (PubChem CID 111538677) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide.

Molecular Properties

Compound Name2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide
PubChem CID111538677
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide
SMILESCC(=O)c1ccccc1C(=O)NCC1(O)CCCC1
InChIInChI=1S/C15H19NO3/c1-11(17)12-6-2-3-7-13(12)14(18)16-10-15(19)8-4-5-9-15/h2-3,6-7,19H,4-5,8-10H2,1H3,(H,16,18)
InChIKeyFDISIVKUKXYPJE-UHFFFAOYSA-N
XLogP1.92
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-[(1-hydroxycyclopentyl)methyl]benzamide
CID 65113744
N-[(1-hydroxycycloheptyl)methyl]-2-methylbenzamide
CID 22267456
2,3-dihydroxy-N-[(1-hydroxycycloheptyl)methyl]benzamide
CID 114344927
2-hydroxy-N-[(1-hydroxycyclohexyl)methyl]-3-methylbenzamide
CID 65113571
2-fluoro-N-[(1-hydroxycyclopentyl)methyl]-3-methylbenzamide
CID 80711895
N-[(1-hydroxycyclobutyl)methyl]-2-phenylbenzamide
CID 111445443
3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylbenzamide
CID 65103774
3-chloro-N-[(1-hydroxycycloheptyl)methyl]-2-methylbenzamide
CID 107097792
N-[(1-hydroxycyclohexyl)methyl]-2-(thiophene-2-carbonyl)benzamide
CID 111446061
2-anilino-N-[(1-hydroxycyclobutyl)methyl]benzamide
CID 111445640
2-hydroxy-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]benzamide
CID 65119121
3-amino-N-[(1-hydroxycyclopentyl)methyl]naphthalene-2-carboxamide
CID 65106022

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide?
The IUPAC name of 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide (CID 111538677) is 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide.
What is the SMILES notation for 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide?
The canonical SMILES for 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide is CC(=O)c1ccccc1C(=O)NCC1(O)CCCC1.
What is the InChIKey of 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide?
The InChIKey is FDISIVKUKXYPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-11(17)12-6-2-3-7-13(12)14(18)16-10-15(19)8-4-5-9-15/h2-3,6-7,19H,4-5,8-10H2,1H3,(H,16,18).
What are the key properties of 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide?
2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide has a molecular weight of 261.32 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-[(1-hydroxycyclopentyl)methyl]benzamide is sourced from PubChem (CID 111538677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).