4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide

C17H17ClN2O2 — CID 27769015

IUPAC4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2Cl)cc1
InChIInChI=1S/C17H17ClN2O2/c1-11(15-5-3-4-6-16(15)18)19-17(22)13-7-9-14(10-8-13)20-12(2)21/h3-11H,1-2H3,(H,19,22)(H,20,21)/t11-/m1/s1
InChIKeyOCGSVNBYJZYIME-LLVKDONJSA-N
MW316.79 g/mol
LogP3.79
Rot. Bonds4

About 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide

4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide (PubChem CID 27769015) has the molecular formula C17H17ClN2O2 and a molecular weight of 316.79 g/mol. Its IUPAC name is 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide
PubChem CID27769015
Molecular FormulaC17H17ClN2O2
Molecular Weight316.79 g/mol
Exact Mass316.10
IUPAC Name4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2Cl)cc1
InChIInChI=1S/C17H17ClN2O2/c1-11(15-5-3-4-6-16(15)18)19-17(22)13-7-9-14(10-8-13)20-12(2)21/h3-11H,1-2H3,(H,19,22)(H,20,21)/t11-/m1/s1
InChIKeyOCGSVNBYJZYIME-LLVKDONJSA-N
XLogP3.79
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.79
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-acetamido-N-[(1R)-1-(2-methylphenyl)ethyl]benzamide
CID 51456710
N-[4-[1-(2-chlorophenyl)ethylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 55373079
N-[4-[1-(2-chlorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 51205981
4-(chloromethyl)-N-[(1S)-1-(2-chlorophenyl)ethyl]benzamide
CID 81377370
[2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl] 4-acetamidobenzoate
CID 7654378
4-acetamido-N-(1-phenylethyl)benzamide
CID 2841785
N-[1-(2-chlorophenyl)ethyl]-4-methylsulfinylbenzamide
CID 51185029
N-[1-(2-chlorophenyl)ethyl]-4-sulfamoylbenzamide
CID 42910401
4-(2-aminoethyl)-N-[(1S)-1-(2-chlorophenyl)ethyl]benzamide
CID 81375650
4-(benzenesulfonylmethyl)-N-[1-(2-chlorophenyl)ethyl]benzamide
CID 55758138
N-[1-(2-chlorophenyl)ethyl]-3-hydroxy-4-methylbenzamide
CID 60701286
4-acetamido-N-[(1R)-1-(2,4-difluorophenyl)ethyl]benzamide
CID 26172289

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide?
The IUPAC name of 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide (CID 27769015) is 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide.
What is the SMILES notation for 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide?
The canonical SMILES for 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide is CC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2Cl)cc1.
What is the InChIKey of 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide?
The InChIKey is OCGSVNBYJZYIME-LLVKDONJSA-N. The full InChI is InChI=1S/C17H17ClN2O2/c1-11(15-5-3-4-6-16(15)18)19-17(22)13-7-9-14(10-8-13)20-12(2)21/h3-11H,1-2H3,(H,19,22)(H,20,21)/t11-/m1/s1.
What are the key properties of 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide?
4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide has a molecular weight of 316.79 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide is sourced from PubChem (CID 27769015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).