4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide

C17H19N3O2 — CID 60571357

IUPAC4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)N(C)C(C)c2ccncc2)cc1
InChIInChI=1S/C17H19N3O2/c1-12(14-8-10-18-11-9-14)20(3)17(22)15-4-6-16(7-5-15)19-13(2)21/h4-12H,1-3H3,(H,19,21)
InChIKeySQRTYPCJJLAOTC-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.87
Rot. Bonds4

About 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide

4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide (PubChem CID 60571357) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide.

Molecular Properties

Compound Name4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide
PubChem CID60571357
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)N(C)C(C)c2ccncc2)cc1
InChIInChI=1S/C17H19N3O2/c1-12(14-8-10-18-11-9-14)20(3)17(22)15-4-6-16(7-5-15)19-13(2)21/h4-12H,1-3H3,(H,19,21)
InChIKeySQRTYPCJJLAOTC-UHFFFAOYSA-N
XLogP2.87
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(phenylcarbamoylamino)-N-(1-pyridin-4-ylethyl)benzamide
CID 60571084
4-[(4-fluorophenyl)sulfonylamino]-N-methyl-N-(1-pyridin-4-ylethyl)benzamide
CID 60571190
3-amino-4-bromo-N-methyl-N-(1-pyridin-4-ylethyl)benzamide
CID 61116655
4-[(3,4-dimethylphenyl)sulfonylamino]-N-methyl-N-(1-pyridin-4-ylethyl)benzamide
CID 60571081
3,5-dibromo-4-hydroxy-N-methyl-N-[(1R)-1-pyridin-4-ylethyl]benzamide
CID 97326605
N-methyl-N-[(1S)-1-pyridin-4-ylethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93375712
N-methyl-N-(1-pyridin-4-ylethyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998577
N-methyl-4-[(2-methylphenyl)sulfamoyl]-N-(1-pyridin-4-ylethyl)benzamide
CID 60571008
4-benzamido-N-[1-(3-benzamidophenyl)ethyl]-N-methylbenzamide
CID 46537045
4-acetamido-N-methyl-N-pyridin-3-ylbenzamide
CID 59607027
2-amino-N-methyl-N-(1-pyridin-4-ylethyl)propanamide
CID 60964247
N-methyl-N-(1-pyridin-4-ylethyl)-7,8-dihydronaphthalene-2-carboxamide
CID 102563215

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide?
The IUPAC name of 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide (CID 60571357) is 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide.
What is the SMILES notation for 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide?
The canonical SMILES for 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide is CC(=O)Nc1ccc(C(=O)N(C)C(C)c2ccncc2)cc1.
What is the InChIKey of 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide?
The InChIKey is SQRTYPCJJLAOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-12(14-8-10-18-11-9-14)20(3)17(22)15-4-6-16(7-5-15)19-13(2)21/h4-12H,1-3H3,(H,19,21).
What are the key properties of 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide?
4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide has a molecular weight of 297.36 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-methyl-N-(1-pyridin-4-ylethyl)benzamide is sourced from PubChem (CID 60571357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).