2-(4-methylphenyl)-N-pyridin-3-ylacetamide

C14H14N2O — CID 890802

IUPAC2-(4-methylphenyl)-N-pyridin-3-ylacetamide
SMILESCc1ccc(CC(=O)Nc2cccnc2)cc1
InChIInChI=1S/C14H14N2O/c1-11-4-6-12(7-5-11)9-14(17)16-13-3-2-8-15-10-13/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyZOYDVHXTTRUCKI-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.57
Rot. Bonds3

About 2-(4-methylphenyl)-N-pyridin-3-ylacetamide

2-(4-methylphenyl)-N-pyridin-3-ylacetamide (PubChem CID 890802) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-pyridin-3-ylacetamide
PubChem CID890802
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name2-(4-methylphenyl)-N-pyridin-3-ylacetamide
SMILESCc1ccc(CC(=O)Nc2cccnc2)cc1
InChIInChI=1S/C14H14N2O/c1-11-4-6-12(7-5-11)9-14(17)16-13-3-2-8-15-10-13/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyZOYDVHXTTRUCKI-UHFFFAOYSA-N
XLogP2.57
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
CID 177434462
1-(4-methylphenyl)-3-pyridin-3-ylurea
CID 790714
2-[4-(N'-hydroxycarbamimidoyl)phenyl]-N-pyridin-3-ylacetamide
CID 77001775
2-(5-methyl-1-benzofuran-3-yl)-N-pyridin-3-ylacetamide
CID 2973081
2-(2-fluorophenyl)-N-pyridin-3-ylacetamide
CID 4195275
2-(4-methylphenyl)-N-(1-pyridin-3-ylethyl)acetamide
CID 18163057
[5-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]carbamic acid
CID 90107603
3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide
CID 129281433
N-(4-methylphenyl)-N'-[[4-oxo-4-(pyridin-3-ylamino)butan-2-ylidene]amino]oxamide
CID 78460789
2-[(4-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide
CID 118911654
N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide
CID 37194021
2-(4-methylphenyl)-N-(2-methyl-4-pyridinyl)acetamide
CID 110756851

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(4-methylphenyl)-N-pyridin-3-ylacetamide (CID 890802) is 2-(4-methylphenyl)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-pyridin-3-ylacetamide is Cc1ccc(CC(=O)Nc2cccnc2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-pyridin-3-ylacetamide?
The InChIKey is ZOYDVHXTTRUCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-11-4-6-12(7-5-11)9-14(17)16-13-3-2-8-15-10-13/h2-8,10H,9H2,1H3,(H,16,17).
What are the key properties of 2-(4-methylphenyl)-N-pyridin-3-ylacetamide?
2-(4-methylphenyl)-N-pyridin-3-ylacetamide has a molecular weight of 226.28 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 890802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).