N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide

C15H18N2O2 — CID 115766537

IUPACN-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC(=O)c1ccc(NC(=O)N2CC=C(C)CC2)cc1
InChIInChI=1S/C15H18N2O2/c1-11-7-9-17(10-8-11)15(19)16-14-5-3-13(4-6-14)12(2)18/h3-7H,8-10H2,1-2H3,(H,16,19)
InChIKeyUVURTSKIOZSUAU-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.07
Rot. Bonds2

About N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide

N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 115766537) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID115766537
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC(=O)c1ccc(NC(=O)N2CC=C(C)CC2)cc1
InChIInChI=1S/C15H18N2O2/c1-11-7-9-17(10-8-11)15(19)16-14-5-3-13(4-6-14)12(2)18/h3-7H,8-10H2,1-2H3,(H,16,19)
InChIKeyUVURTSKIOZSUAU-UHFFFAOYSA-N
XLogP3.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[4-(ethylcarbamoyl)phenyl]-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 72921925
N-(4-acetylphenyl)-4-(methoxymethyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 114412428
N-(4-acetylphenyl)-4-methylpiperazine-1-carboxamide
CID 47127479
4-methyl-N-(2-methyl-1,3-benzothiazol-5-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 72858123
N-(4-acetylphenyl)-3-methylpyrrolidine-1-carboxamide
CID 61347422
(E)-3-[3-[(4-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)amino]phenyl]prop-2-enoic acid
CID 114411863
3,5-dichloro-4-[(4-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)amino]benzoic acid
CID 114411862
1-[(4-acetylphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 63031650
N-(4-acetylphenyl)-4-pyridin-4-ylpiperazine-1-carboxamide
CID 86920409
N-(4-acetylphenyl)-4-hydroxy-4-methylazepane-1-carboxamide
CID 107406879
N-(4-acetylphenyl)-4-cyano-4-methylpiperidine-1-carboxamide
CID 103993105
4-cyclopropylidene-N-(4-methylphenyl)piperidine-1-carboxamide
CID 121187165

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide (CID 115766537) is N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide is CC(=O)c1ccc(NC(=O)N2CC=C(C)CC2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is UVURTSKIOZSUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-11-7-9-17(10-8-11)15(19)16-14-5-3-13(4-6-14)12(2)18/h3-7H,8-10H2,1-2H3,(H,16,19).
What are the key properties of N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 115766537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).