N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide

C22H26N2O2 — CID 53051206

IUPACN-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)C2=CCN(Cc3cccc(C)c3)CC2)c(C)c1
InChIInChI=1S/C22H26N2O2/c1-16-5-4-6-18(13-16)15-24-11-9-19(10-12-24)22(25)23-21-8-7-20(26-3)14-17(21)2/h4-9,13-14H,10-12,15H2,1-3H3,(H,23,25)
InChIKeyAREKRJLARVHUDH-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.08
Rot. Bonds5

About N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide

N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide (PubChem CID 53051206) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
PubChem CID53051206
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)C2=CCN(Cc3cccc(C)c3)CC2)c(C)c1
InChIInChI=1S/C22H26N2O2/c1-16-5-4-6-18(13-16)15-24-11-9-19(10-12-24)22(25)23-21-8-7-20(26-3)14-17(21)2/h4-9,13-14H,10-12,15H2,1-3H3,(H,23,25)
InChIKeyAREKRJLARVHUDH-UHFFFAOYSA-N
XLogP4.08
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-methylphenyl)methyl]-N-(3-methylsulfanylphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051194
1-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929937
1-[(3-methylphenyl)methyl]-N-(1-phenylethyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051197
1-[(4-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929946
N-[(2,5-difluorophenyl)methyl]-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051196
N-(2,4-dimethylphenyl)-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 9266501
1-(4-methoxy-2-methylphenyl)-3-(3-methylphenyl)urea
CID 46860185
(3R)-3-hydroxy-N-[2-methyl-4-[(3-methylphenyl)methoxy]phenyl]pyrrolidine-1-carboxamide
CID 111431674
ethyl 1-benzyl-3,6-dihydro-2H-pyridine-4-carboxylate
CID 787906
2-[(3aR,9aS)-4-[(3-methylphenyl)methyl]-5-oxo-2,3,3a,6,7,8,9,9a-octahydropyrrolo[3,2-b]azocin-1-yl]-N-(2-acetamido-5-methoxyphenyl)acetamide
CID 110076459
2-(4-methoxy-2-methylanilino)-N-(3-methylphenyl)acetamide
CID 62872071
N-(2,4-dimethoxyphenyl)-2-[6-[(3-methylphenyl)methyl]-1,1-dioxo-1,2,6-thiadiazinan-2-yl]acetamide
CID 18590916

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
The IUPAC name of N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide (CID 53051206) is N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide.
What is the SMILES notation for N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
The canonical SMILES for N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide is COc1ccc(NC(=O)C2=CCN(Cc3cccc(C)c3)CC2)c(C)c1.
What is the InChIKey of N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
The InChIKey is AREKRJLARVHUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-16-5-4-6-18(13-16)15-24-11-9-19(10-12-24)22(25)23-21-8-7-20(26-3)14-17(21)2/h4-9,13-14H,10-12,15H2,1-3H3,(H,23,25).
What are the key properties of N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylphenyl)-1-[(3-methylphenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide is sourced from PubChem (CID 53051206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).