2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide

C16H16ClN3O2 — CID 175338738

IUPAC2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide
SMILESCNC(=O)NC(=O)C(c1cc(C)ccn1)c1ccccc1Cl
InChIInChI=1S/C16H16ClN3O2/c1-10-7-8-19-13(9-10)14(15(21)20-16(22)18-2)11-5-3-4-6-12(11)17/h3-9,14H,1-2H3,(H2,18,20,21,22)
InChIKeyPXLXUNNPJBBPHX-UHFFFAOYSA-N
MW317.78 g/mol
LogP2.63
Rot. Bonds3

About 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide

2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide (PubChem CID 175338738) has the molecular formula C16H16ClN3O2 and a molecular weight of 317.78 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide
PubChem CID175338738
Molecular FormulaC16H16ClN3O2
Molecular Weight317.78 g/mol
Exact Mass317.09
IUPAC Name2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide
SMILESCNC(=O)NC(=O)C(c1cc(C)ccn1)c1ccccc1Cl
InChIInChI=1S/C16H16ClN3O2/c1-10-7-8-19-13(9-10)14(15(21)20-16(22)18-2)11-5-3-4-6-12(11)17/h3-9,14H,1-2H3,(H2,18,20,21,22)
InChIKeyPXLXUNNPJBBPHX-UHFFFAOYSA-N
XLogP2.63
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]cyclohexyl]propanamide
CID 138490227
(+)-2-chloro-N-(3-(1-(trifluoromethyl)cyclopropyl)-2-(2-(trifluoromethyl)pyridin-5-yl)propyl)benzamide
CID 73673308
2-(2,6-dichlorophenyl)-N-(pyridin-4-yl)acetamide
CID 17173956
2-(2-chloro-6-fluorophenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 839135
4-(4-chlorophenyl)-N-(3-pyridinylmethyl)cyclohexanecarboxamide
CID 2815214
4-(4-chlorophenyl)-N-(4-pyridinylmethyl)cyclohexanecarboxamide
CID 2815215
2-(2-chlorophenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 2971027
3-(carbamoylamino)-3-(2-chlorophenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 4884349
2-[3-(2-chlorobenzyl)-2-oxoimidazolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 15993317
2-(2,4-dichlorophenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 16250036
2-(2-chloro-6-fluorophenyl)-N-4-pyridinylacetamide
CID 974101
Benzeneacetamide,4-chloro-N-[1-[[(cyanoamino)[(2-methyl-3-pyridinyl)imino]methyl]amino]-2,2-dimethylpropyl]-
CID 11223687

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide (CID 175338738) is 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide is CNC(=O)NC(=O)C(c1cc(C)ccn1)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide?
The InChIKey is PXLXUNNPJBBPHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2/c1-10-7-8-19-13(9-10)14(15(21)20-16(22)18-2)11-5-3-4-6-12(11)17/h3-9,14H,1-2H3,(H2,18,20,21,22).
What are the key properties of 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide?
2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide has a molecular weight of 317.78 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(methylcarbamoyl)-2-(4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 175338738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).