N-benzyl-2-chloro-N-phenylacetamide

C15H14ClNO — CID 1480187

IUPACN-benzyl-2-chloro-N-phenylacetamide
SMILESO=C(CCl)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H14ClNO/c16-11-15(18)17(14-9-5-2-6-10-14)12-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKeyCFSKJDUGDLZDTI-UHFFFAOYSA-N
MW259.74 g/mol
LogP3.46
Rot. Bonds4

About N-benzyl-2-chloro-N-phenylacetamide

N-benzyl-2-chloro-N-phenylacetamide (PubChem CID 1480187) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is N-benzyl-2-chloro-N-phenylacetamide.

Molecular Properties

Compound NameN-benzyl-2-chloro-N-phenylacetamide
PubChem CID1480187
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC NameN-benzyl-2-chloro-N-phenylacetamide
SMILESO=C(CCl)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H14ClNO/c16-11-15(18)17(14-9-5-2-6-10-14)12-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKeyCFSKJDUGDLZDTI-UHFFFAOYSA-N
XLogP3.46
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

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CID 606505
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2-chloro-N-(3-methylphenyl)acetamide
CID 296325
2-Chloro-N-(4-methylphenyl)acetamide
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2-chloro-N-(((2-methylphenyl)carbamoyl)methyl)-N-propylacetamide
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-chloro-N-phenylacetamide?
The IUPAC name of N-benzyl-2-chloro-N-phenylacetamide (CID 1480187) is N-benzyl-2-chloro-N-phenylacetamide.
What is the SMILES notation for N-benzyl-2-chloro-N-phenylacetamide?
The canonical SMILES for N-benzyl-2-chloro-N-phenylacetamide is O=C(CCl)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-2-chloro-N-phenylacetamide?
The InChIKey is CFSKJDUGDLZDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO/c16-11-15(18)17(14-9-5-2-6-10-14)12-13-7-3-1-4-8-13/h1-10H,11-12H2.
What are the key properties of N-benzyl-2-chloro-N-phenylacetamide?
N-benzyl-2-chloro-N-phenylacetamide has a molecular weight of 259.74 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-chloro-N-phenylacetamide is sourced from PubChem (CID 1480187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).