2-[1-(4-chlorophenyl)propan-2-yl]benzamide

C16H16ClNO — CID 142688432

IUPAC2-[1-(4-chlorophenyl)propan-2-yl]benzamide
SMILESCC(Cc1ccc(Cl)cc1)c1ccccc1C(N)=O
InChIInChI=1S/C16H16ClNO/c1-11(10-12-6-8-13(17)9-7-12)14-4-2-3-5-15(14)16(18)19/h2-9,11H,10H2,1H3,(H2,18,19)
InChIKeyGXROPRAXBRUWDQ-UHFFFAOYSA-N
MW273.76 g/mol
LogP3.79
Rot. Bonds4

About 2-[1-(4-chlorophenyl)propan-2-yl]benzamide

2-[1-(4-chlorophenyl)propan-2-yl]benzamide (PubChem CID 142688432) has the molecular formula C16H16ClNO and a molecular weight of 273.76 g/mol. Its IUPAC name is 2-[1-(4-chlorophenyl)propan-2-yl]benzamide.

Molecular Properties

Compound Name2-[1-(4-chlorophenyl)propan-2-yl]benzamide
PubChem CID142688432
Molecular FormulaC16H16ClNO
Molecular Weight273.76 g/mol
Exact Mass273.09
IUPAC Name2-[1-(4-chlorophenyl)propan-2-yl]benzamide
SMILESCC(Cc1ccc(Cl)cc1)c1ccccc1C(N)=O
InChIInChI=1S/C16H16ClNO/c1-11(10-12-6-8-13(17)9-7-12)14-4-2-3-5-15(14)16(18)19/h2-9,11H,10H2,1H3,(H2,18,19)
InChIKeyGXROPRAXBRUWDQ-UHFFFAOYSA-N
XLogP3.79
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.76
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(1R)-1-hydroxy-2-phenylethyl]benzamide
CID 91365302
2-[1-(4-chlorophenyl)-3-hydroxypropan-2-yl]-4-methylbenzamide
CID 154458103
(2S)-2-[1-(4-chlorophenyl)propan-2-ylamino]-3-phenylpropanoic acid
CID 122037636
azane;1-chloro-4-(2-phenylpropyl)benzene
CID 67712446
N-[1-(4-chlorophenyl)propan-2-yl]-2-methylpropanamide
CID 60769951
2-[1-(4-chlorophenyl)propan-2-ylamino]propanoic acid
CID 66173510
3-(4-chlorophenyl)-2-[(4-chlorophenyl)methyl]-1-(2-hydroxyphenyl)propan-1-one
CID 154710089
2-[(2R)-1-(2,2,2-trifluoroethylsulfanyl)propan-2-yl]benzamide
CID 140746980
2-chloro-N-[1-(4-chlorophenyl)propan-2-yl]-2-phenylacetamide
CID 43697058
2-anilino-N-[1-(4-chlorophenyl)propan-2-yl]acetamide
CID 60860440
1-(4-chlorophenyl)-N-[1-(2-fluorophenyl)ethyl]propan-2-amine
CID 43677712
(2R)-3-(4-chlorophenyl)-2-iodopropanamide
CID 138478190

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-chlorophenyl)propan-2-yl]benzamide?
The IUPAC name of 2-[1-(4-chlorophenyl)propan-2-yl]benzamide (CID 142688432) is 2-[1-(4-chlorophenyl)propan-2-yl]benzamide.
What is the SMILES notation for 2-[1-(4-chlorophenyl)propan-2-yl]benzamide?
The canonical SMILES for 2-[1-(4-chlorophenyl)propan-2-yl]benzamide is CC(Cc1ccc(Cl)cc1)c1ccccc1C(N)=O.
What is the InChIKey of 2-[1-(4-chlorophenyl)propan-2-yl]benzamide?
The InChIKey is GXROPRAXBRUWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO/c1-11(10-12-6-8-13(17)9-7-12)14-4-2-3-5-15(14)16(18)19/h2-9,11H,10H2,1H3,(H2,18,19).
What are the key properties of 2-[1-(4-chlorophenyl)propan-2-yl]benzamide?
2-[1-(4-chlorophenyl)propan-2-yl]benzamide has a molecular weight of 273.76 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-chlorophenyl)propan-2-yl]benzamide is sourced from PubChem (CID 142688432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).