2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide

C11H12ClNO2 — CID 64996556

IUPAC2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide
SMILESCC(=O)CNC(=O)Cc1ccccc1Cl
InChIInChI=1S/C11H12ClNO2/c1-8(14)7-13-11(15)6-9-4-2-3-5-10(9)12/h2-5H,6-7H2,1H3,(H,13,15)
InChIKeyKYJUDQQRNOAQFV-UHFFFAOYSA-N
MW225.68 g/mol
LogP1.59
Rot. Bonds4

About 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide

2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide (PubChem CID 64996556) has the molecular formula C11H12ClNO2 and a molecular weight of 225.68 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide
PubChem CID64996556
Molecular FormulaC11H12ClNO2
Molecular Weight225.68 g/mol
Exact Mass225.06
IUPAC Name2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide
SMILESCC(=O)CNC(=O)Cc1ccccc1Cl
InChIInChI=1S/C11H12ClNO2/c1-8(14)7-13-11(15)6-9-4-2-3-5-10(9)12/h2-5H,6-7H2,1H3,(H,13,15)
InChIKeyKYJUDQQRNOAQFV-UHFFFAOYSA-N
XLogP1.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 9224527
N-[(2-chlorophenyl)methyl]-4-oxopentanamide
CID 60636911
N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide
CID 12841728
N-(2-bromopropyl)-2-(2-chlorophenyl)acetamide
CID 114308630
2-(2-chlorophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 110712323
2-(3,4-dichlorophenyl)-N-(2-oxopropyl)acetamide
CID 64996675
2-(2-chlorophenyl)-N-(2-hydroxy-2-methylbutyl)acetamide
CID 65114916
2-(2-chlorophenyl)-N-(2-hydroxy-3-methylbutyl)acetamide
CID 113258913
2-(2-chlorophenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]acetamide
CID 24550973
3-(2-chlorophenyl)-N-(2-methylprop-2-enyl)propanamide
CID 114618383
2-(2-chlorophenyl)-N-pent-3-ynylacetamide
CID 115977322
N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide
CID 2679601

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide (CID 64996556) is 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide is CC(=O)CNC(=O)Cc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide?
The InChIKey is KYJUDQQRNOAQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClNO2/c1-8(14)7-13-11(15)6-9-4-2-3-5-10(9)12/h2-5H,6-7H2,1H3,(H,13,15).
What are the key properties of 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide?
2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide has a molecular weight of 225.68 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide is sourced from PubChem (CID 64996556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).