N-[(2-bromophenyl)methyl]-2-phenylacetamide

C15H14BrNO — CID 17173126

IUPACN-[(2-bromophenyl)methyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCc1ccccc1Br
InChIInChI=1S/C15H14BrNO/c16-14-9-5-4-8-13(14)11-17-15(18)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)
InChIKeyOEIAXXMNVYBKBP-UHFFFAOYSA-N
MW304.19 g/mol
LogP3.31
Rot. Bonds4

About N-[(2-bromophenyl)methyl]-2-phenylacetamide

N-[(2-bromophenyl)methyl]-2-phenylacetamide (PubChem CID 17173126) has the molecular formula C15H14BrNO and a molecular weight of 304.19 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-2-phenylacetamide
PubChem CID17173126
Molecular FormulaC15H14BrNO
Molecular Weight304.19 g/mol
Exact Mass303.03
IUPAC NameN-[(2-bromophenyl)methyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCc1ccccc1Br
InChIInChI=1S/C15H14BrNO/c16-14-9-5-4-8-13(14)11-17-15(18)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)
InChIKeyOEIAXXMNVYBKBP-UHFFFAOYSA-N
XLogP3.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.19
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-2-phenylacetamide?
The IUPAC name of N-[(2-bromophenyl)methyl]-2-phenylacetamide (CID 17173126) is N-[(2-bromophenyl)methyl]-2-phenylacetamide.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-2-phenylacetamide?
The canonical SMILES for N-[(2-bromophenyl)methyl]-2-phenylacetamide is O=C(Cc1ccccc1)NCc1ccccc1Br.
What is the InChIKey of N-[(2-bromophenyl)methyl]-2-phenylacetamide?
The InChIKey is OEIAXXMNVYBKBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO/c16-14-9-5-4-8-13(14)11-17-15(18)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18).
What are the key properties of N-[(2-bromophenyl)methyl]-2-phenylacetamide?
N-[(2-bromophenyl)methyl]-2-phenylacetamide has a molecular weight of 304.19 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-2-phenylacetamide is sourced from PubChem (CID 17173126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).