2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide

C16H15ClN2O — CID 110373589

IUPAC2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide
SMILESO=C(NC1CC1)C(c1ccc(Cl)cc1)c1ccccn1
InChIInChI=1S/C16H15ClN2O/c17-12-6-4-11(5-7-12)15(14-3-1-2-10-18-14)16(20)19-13-8-9-13/h1-7,10,13,15H,8-9H2,(H,19,20)
InChIKeyMAQSZEAUZJBWMB-UHFFFAOYSA-N
MW286.76 g/mol
LogP3.15
Rot. Bonds4

About 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide

2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide (PubChem CID 110373589) has the molecular formula C16H15ClN2O and a molecular weight of 286.76 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide
PubChem CID110373589
Molecular FormulaC16H15ClN2O
Molecular Weight286.76 g/mol
Exact Mass286.09
IUPAC Name2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide
SMILESO=C(NC1CC1)C(c1ccc(Cl)cc1)c1ccccn1
InChIInChI=1S/C16H15ClN2O/c17-12-6-4-11(5-7-12)15(14-3-1-2-10-18-14)16(20)19-13-8-9-13/h1-7,10,13,15H,8-9H2,(H,19,20)
InChIKeyMAQSZEAUZJBWMB-UHFFFAOYSA-N
XLogP3.15
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide (CID 110373589) is 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide is O=C(NC1CC1)C(c1ccc(Cl)cc1)c1ccccn1.
What is the InChIKey of 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide?
The InChIKey is MAQSZEAUZJBWMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O/c17-12-6-4-11(5-7-12)15(14-3-1-2-10-18-14)16(20)19-13-8-9-13/h1-7,10,13,15H,8-9H2,(H,19,20).
What are the key properties of 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide?
2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide has a molecular weight of 286.76 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-cyclopropyl-2-pyridin-2-ylacetamide is sourced from PubChem (CID 110373589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).