2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide

C14H18ClNO — CID 114549493

IUPAC2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide
SMILESCC1CCC(NC(=O)Cc2ccccc2Cl)C1
InChIInChI=1S/C14H18ClNO/c1-10-6-7-12(8-10)16-14(17)9-11-4-2-3-5-13(11)15/h2-5,10,12H,6-9H2,1H3,(H,16,17)
InChIKeyIIOJXCWFMSIGHP-UHFFFAOYSA-N
MW251.76 g/mol
LogP3.19
Rot. Bonds3

About 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide

2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide (PubChem CID 114549493) has the molecular formula C14H18ClNO and a molecular weight of 251.76 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide
PubChem CID114549493
Molecular FormulaC14H18ClNO
Molecular Weight251.76 g/mol
Exact Mass251.11
IUPAC Name2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide
SMILESCC1CCC(NC(=O)Cc2ccccc2Cl)C1
InChIInChI=1S/C14H18ClNO/c1-10-6-7-12(8-10)16-14(17)9-11-4-2-3-5-13(11)15/h2-5,10,12H,6-9H2,1H3,(H,16,17)
InChIKeyIIOJXCWFMSIGHP-UHFFFAOYSA-N
XLogP3.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.76
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide (CID 114549493) is 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide is CC1CCC(NC(=O)Cc2ccccc2Cl)C1.
What is the InChIKey of 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide?
The InChIKey is IIOJXCWFMSIGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO/c1-10-6-7-12(8-10)16-14(17)9-11-4-2-3-5-13(11)15/h2-5,10,12H,6-9H2,1H3,(H,16,17).
What are the key properties of 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide?
2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide has a molecular weight of 251.76 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide is sourced from PubChem (CID 114549493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).