N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide

C19H24N2O — CID 109019316

IUPACN-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide
SMILESCc1ccccc1CNCCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C19H24N2O/c1-14-7-4-5-10-17(14)13-20-12-11-18(22)21-19-15(2)8-6-9-16(19)3/h4-10,20H,11-13H2,1-3H3,(H,21,22)
InChIKeyQAZWGKPTJFSYEN-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.73
Rot. Bonds6

About N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide

N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide (PubChem CID 109019316) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide
PubChem CID109019316
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide
SMILESCc1ccccc1CNCCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C19H24N2O/c1-14-7-4-5-10-17(14)13-20-12-11-18(22)21-19-15(2)8-6-9-16(19)3/h4-10,20H,11-13H2,1-3H3,(H,21,22)
InChIKeyQAZWGKPTJFSYEN-UHFFFAOYSA-N
XLogP3.73
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[(2-methylphenyl)methylamino]-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 109019326
3-[(2-chlorophenyl)methylamino]-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 109021544
N-(2,6-dimethylphenyl)-3-(propylamino)propanamide
CID 59981693
N-(3-bromo-4-methylphenyl)-3-[(2-methylphenyl)methylamino]propanamide
CID 109019343
N-(2-ethyl-6-methylphenyl)-3-[(4-methylphenyl)methylamino]propanamide
CID 109019985
N-(2-methoxyphenyl)-3-[(2-methylphenyl)methylamino]propanamide
CID 109019344
3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide
CID 109035764
N-(3,4-difluorophenyl)-3-[(2-methylphenyl)methylamino]propanamide
CID 109019409
3-[(2-chlorophenyl)methylamino]-N-(2,6-dichlorophenyl)propanamide
CID 109021615
N-(3-cyanophenyl)-3-[(2-methylphenyl)methylamino]propanamide
CID 109019404
N-[(2-chlorophenyl)methyl]-3-[(2-methylphenyl)methylamino]propanamide
CID 109019248
3-[(2-chlorophenyl)methylamino]-N-(2,6-diethylphenyl)propanamide
CID 109021543

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide (CID 109019316) is N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide is Cc1ccccc1CNCCC(=O)Nc1c(C)cccc1C.
What is the InChIKey of N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide?
The InChIKey is QAZWGKPTJFSYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-14-7-4-5-10-17(14)13-20-12-11-18(22)21-19-15(2)8-6-9-16(19)3/h4-10,20H,11-13H2,1-3H3,(H,21,22).
What are the key properties of N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide?
N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide has a molecular weight of 296.41 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-3-[(2-methylphenyl)methylamino]propanamide is sourced from PubChem (CID 109019316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).