N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide

C14H22N2O2 — CID 115165703

IUPACN-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
SMILESCNC(C)(C)C(=O)NCc1ccc(OC)c(C)c1
InChIInChI=1S/C14H22N2O2/c1-10-8-11(6-7-12(10)18-5)9-16-13(17)14(2,3)15-4/h6-8,15H,9H2,1-5H3,(H,16,17)
InChIKeyPNNRCYWZRJBQMX-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.62
Rot. Bonds5

About N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide

N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide (PubChem CID 115165703) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
PubChem CID115165703
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
SMILESCNC(C)(C)C(=O)NCc1ccc(OC)c(C)c1
InChIInChI=1S/C14H22N2O2/c1-10-8-11(6-7-12(10)18-5)9-16-13(17)14(2,3)15-4/h6-8,15H,9H2,1-5H3,(H,16,17)
InChIKeyPNNRCYWZRJBQMX-UHFFFAOYSA-N
XLogP1.62
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 115165723
2,6-dimethoxy-N-[(4-methoxy-3-methylphenyl)methyl]benzamide
CID 110779766
N-[(5-bromo-2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 115165713
2-methyl-2-(methylamino)-N-[(3-methylphenyl)methyl]propanamide
CID 62847250
2-ethyl-N-[(4-methoxy-3-methylphenyl)methyl]butanamide
CID 110779755
N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 62834293
3-[(4-methoxy-3-methylphenyl)methylamino]-2,2,3-trimethylbutanoic acid
CID 167848707
N-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-N'-(2,4,6-trimethylphenyl)propanediamide
CID 108965125
3-amino-N-[(4-methoxy-3-methylphenyl)methyl]butanamide
CID 115154159
N-benzyl-2-methyl-2-(methylamino)propanamide
CID 62834477
2-methyl-2-(methylamino)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]propanamide
CID 115165741
1-(3-hydroxy-4-methylpentyl)-3-[(4-methoxy-3-methylphenyl)methyl]urea
CID 111505713

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The IUPAC name of N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide (CID 115165703) is N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide.
What is the SMILES notation for N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The canonical SMILES for N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide is CNC(C)(C)C(=O)NCc1ccc(OC)c(C)c1.
What is the InChIKey of N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The InChIKey is PNNRCYWZRJBQMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-8-11(6-7-12(10)18-5)9-16-13(17)14(2,3)15-4/h6-8,15H,9H2,1-5H3,(H,16,17).
What are the key properties of N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide has a molecular weight of 250.34 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide is sourced from PubChem (CID 115165703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).