2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide

C16H22ClNO3 — CID 91765732

IUPAC2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide
SMILESCOCC1(CNC(=O)C(O)c2ccccc2Cl)CCCC1
InChIInChI=1S/C16H22ClNO3/c1-21-11-16(8-4-5-9-16)10-18-15(20)14(19)12-6-2-3-7-13(12)17/h2-3,6-7,14,19H,4-5,8-11H2,1H3,(H,18,20)
InChIKeyRYIFCBXQHMDHDG-UHFFFAOYSA-N
MW311.81 g/mol
LogP2.70
Rot. Bonds6

About 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide

2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide (PubChem CID 91765732) has the molecular formula C16H22ClNO3 and a molecular weight of 311.81 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide
PubChem CID91765732
Molecular FormulaC16H22ClNO3
Molecular Weight311.81 g/mol
Exact Mass311.13
IUPAC Name2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide
SMILESCOCC1(CNC(=O)C(O)c2ccccc2Cl)CCCC1
InChIInChI=1S/C16H22ClNO3/c1-21-11-16(8-4-5-9-16)10-18-15(20)14(19)12-6-2-3-7-13(12)17/h2-3,6-7,14,19H,4-5,8-11H2,1H3,(H,18,20)
InChIKeyRYIFCBXQHMDHDG-UHFFFAOYSA-N
XLogP2.70
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.81
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chloro-2-methylphenyl)-3-[[1-(methoxymethyl)cyclobutyl]methyl]urea
CID 131926247
N-[[1-(methoxymethyl)cyclohexyl]methyl]-2-pyridin-2-ylpropanamide
CID 154799526
2-chloro-N-[1-[[4-(methoxymethyl)piperidin-4-yl]methylamino]-3-methyl-1-oxobutan-2-yl]benzamide
CID 120889665
2-(2-chlorophenyl)-2-hydroxy-N-methylacetamide
CID 23548439
N-benzyl-2-(2-chlorophenyl)-2-hydroxyacetamide
CID 54257135
2-(2,3-dichlorophenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]propanamide;hydrochloride
CID 120890520
2-chloro-N-[[1-(methoxymethyl)cyclopentyl]methyl]-3-methylbenzamide
CID 91774714
(2S)-N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-phenylacetamide
CID 167798849
4-[2-(hydroxymethyl)phenyl]-N-[[1-(methoxymethyl)cyclobutyl]methyl]benzamide
CID 119063800
N-[[1-(methoxymethyl)cyclobutyl]methyl]-3-phenylprop-2-enamide
CID 171134458
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-phenylbutanamide
CID 120887701
(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[[4-[(1R)-1-hydroxyethyl]phenyl]methyl]acetamide
CID 124614262

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide (CID 91765732) is 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide is COCC1(CNC(=O)C(O)c2ccccc2Cl)CCCC1.
What is the InChIKey of 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide?
The InChIKey is RYIFCBXQHMDHDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClNO3/c1-21-11-16(8-4-5-9-16)10-18-15(20)14(19)12-6-2-3-7-13(12)17/h2-3,6-7,14,19H,4-5,8-11H2,1H3,(H,18,20).
What are the key properties of 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide?
2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide has a molecular weight of 311.81 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-hydroxy-N-[[1-(methoxymethyl)cyclopentyl]methyl]acetamide is sourced from PubChem (CID 91765732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).