2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide

C13H10BrClN2O — CID 115627297

IUPAC2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide
SMILESO=C(Cc1cccc(Br)c1)Nc1cc(Cl)ccn1
InChIInChI=1S/C13H10BrClN2O/c14-10-3-1-2-9(6-10)7-13(18)17-12-8-11(15)4-5-16-12/h1-6,8H,7H2,(H,16,17,18)
InChIKeyPUVNSAXXIIJXRQ-UHFFFAOYSA-N
MW325.59 g/mol
LogP3.68
Rot. Bonds3

About 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide

2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide (PubChem CID 115627297) has the molecular formula C13H10BrClN2O and a molecular weight of 325.59 g/mol. Its IUPAC name is 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide
PubChem CID115627297
Molecular FormulaC13H10BrClN2O
Molecular Weight325.59 g/mol
Exact Mass323.97
IUPAC Name2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide
SMILESO=C(Cc1cccc(Br)c1)Nc1cc(Cl)ccn1
InChIInChI=1S/C13H10BrClN2O/c14-10-3-1-2-9(6-10)7-13(18)17-12-8-11(15)4-5-16-12/h1-6,8H,7H2,(H,16,17,18)
InChIKeyPUVNSAXXIIJXRQ-UHFFFAOYSA-N
XLogP3.68
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.59
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-pyridinyl)-2-(3-methylsulfonylphenyl)acetamide
CID 172570951
N-(2-bromo-4-chlorophenyl)-2-(3-bromophenyl)acetamide
CID 81271927
N-(4-chloro-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 115626697
N-(4-chloro-2-pyridinyl)-2-hydroxyacetamide
CID 83768276
2-(3-chlorophenyl)-N-pyrazin-2-ylacetamide
CID 127120451
N-(4-chloro-2-pyridinyl)-2-(4-nitrophenyl)acetamide
CID 115577532
2-(3-bromophenyl)-N-(2-chloro-5-methyl-3-pyridinyl)acetamide
CID 102979817
1-benzyl-3-(4-chloro-2-pyridinyl)urea
CID 108871348
N-[4-(3-bromoanilino)quinazolin-6-yl]-2-(3-chlorophenyl)acetamide
CID 174705931
2-(3-bromophenyl)-N-(3,5-dimethylphenyl)acetamide
CID 100697605
3-chloro-N-(4-chloro-2-pyridinyl)benzamide
CID 3011465
2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide
CID 60615735

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide?
The IUPAC name of 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide (CID 115627297) is 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide?
The canonical SMILES for 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide is O=C(Cc1cccc(Br)c1)Nc1cc(Cl)ccn1.
What is the InChIKey of 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide?
The InChIKey is PUVNSAXXIIJXRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrClN2O/c14-10-3-1-2-9(6-10)7-13(18)17-12-8-11(15)4-5-16-12/h1-6,8H,7H2,(H,16,17,18).
What are the key properties of 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide?
2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide has a molecular weight of 325.59 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide is sourced from PubChem (CID 115627297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).