N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide

C14H17ClN2O3 — CID 110015470

IUPACN-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide
SMILESCC(=O)Nc1cc(NC(=O)C2CCCC2O)ccc1Cl
InChIInChI=1S/C14H17ClN2O3/c1-8(18)16-12-7-9(5-6-11(12)15)17-14(20)10-3-2-4-13(10)19/h5-7,10,13,19H,2-4H2,1H3,(H,16,18)(H,17,20)
InChIKeyJQFMQVVZPOFDGP-UHFFFAOYSA-N
MW296.75 g/mol
LogP2.40
Rot. Bonds3

About N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide

N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110015470) has the molecular formula C14H17ClN2O3 and a molecular weight of 296.75 g/mol. Its IUPAC name is N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide
PubChem CID110015470
Molecular FormulaC14H17ClN2O3
Molecular Weight296.75 g/mol
Exact Mass296.09
IUPAC NameN-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide
SMILESCC(=O)Nc1cc(NC(=O)C2CCCC2O)ccc1Cl
InChIInChI=1S/C14H17ClN2O3/c1-8(18)16-12-7-9(5-6-11(12)15)17-14(20)10-3-2-4-13(10)19/h5-7,10,13,19H,2-4H2,1H3,(H,16,18)(H,17,20)
InChIKeyJQFMQVVZPOFDGP-UHFFFAOYSA-N
XLogP2.40
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.75
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetamido-4-chlorophenyl)cyclohexanecarboxamide
CID 47408126
2-[(5-acetamido-2-chlorophenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 119180306
N-(5-acetamido-2-chlorophenyl)-3-aminocyclohexane-1-carboxamide
CID 119707616
N-(3-acetylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013625
N-(3,5-dimethylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013635
N-(5-acetamido-2-chlorophenyl)piperidine-4-carboxamide
CID 119280735
N-(5-acetamido-2-chlorophenyl)pyrrolidine-2-carboxamide
CID 119280739
N-[3-(2,2-dimethylpropanoylamino)-4-methylphenyl]-2-hydroxycyclopentane-1-carboxamide
CID 110015790
N-(3-acetamido-4-chlorophenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 86845064
4-(3-acetamido-4-chloroanilino)-4-oxobutanoic acid
CID 881020
trans-(1R,2R)-2-[(3,4-dichlorophenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 763889
2-hydroxy-N-pyridin-4-ylcyclopentane-1-carboxamide
CID 110013769

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide (CID 110015470) is N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide is CC(=O)Nc1cc(NC(=O)C2CCCC2O)ccc1Cl.
What is the InChIKey of N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is JQFMQVVZPOFDGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O3/c1-8(18)16-12-7-9(5-6-11(12)15)17-14(20)10-3-2-4-13(10)19/h5-7,10,13,19H,2-4H2,1H3,(H,16,18)(H,17,20).
What are the key properties of N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide?
N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 296.75 g/mol, XLogP of 2.40, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110015470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).