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

C19H24N2O2 — CID 109019419

IUPAC3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide
SMILESCOc1ccccc1CNCCC(=O)NCc1cccc(C)c1
InChIInChI=1S/C19H24N2O2/c1-15-6-5-7-16(12-15)13-21-19(22)10-11-20-14-17-8-3-4-9-18(17)23-2/h3-9,12,20H,10-11,13-14H2,1-2H3,(H,21,22)
InChIKeyHWGVMTUKQCBFHZ-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.80
Rot. Bonds8

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

3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide (PubChem CID 109019419) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide
PubChem CID109019419
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide
SMILESCOc1ccccc1CNCCC(=O)NCc1cccc(C)c1
InChIInChI=1S/C19H24N2O2/c1-15-6-5-7-16(12-15)13-21-19(22)10-11-20-14-17-8-3-4-9-18(17)23-2/h3-9,12,20H,10-11,13-14H2,1-2H3,(H,21,22)
InChIKeyHWGVMTUKQCBFHZ-UHFFFAOYSA-N
XLogP2.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2-methoxyphenyl)methyl]-3-[(3-methylphenyl)methylamino]propanamide
CID 109019582
N-[(2-chlorophenyl)methyl]-3-[(3-methylphenyl)methylamino]propanamide
CID 109019580
N-[(3-methylphenyl)methyl]-3-[(4-methylphenyl)methylamino]propanamide
CID 109019412
3-[(4-fluorophenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide
CID 109019416
3-[2-(4-methoxyphenoxy)ethylamino]-N-[(3-methylphenyl)methyl]propanamide
CID 109019458
N-[2-(2-methoxyphenyl)ethyl]-3-[(4-methylphenyl)methylamino]propanamide
CID 109019924
3-(2,5-dimethylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022003
N-[(2-ethoxyphenyl)methyl]-3-(3-methylphenyl)propanamide
CID 60565788
N-[(3-methylphenyl)methyl]-3-(2-methylpropylamino)propanamide
CID 109012751
N-benzyl-3-[(2,3,4-trimethoxyphenyl)methylamino]propanamide
CID 51129427
3-methoxy-N-[(3-methylphenyl)methyl]propanamide
CID 71248457
3-(2,6-diethylanilino)-N-[(3-methylphenyl)methyl]propanamide
CID 109019490

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide?
The IUPAC name of 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide (CID 109019419) is 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide.
What is the SMILES notation for 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide?
The canonical SMILES for 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide is COc1ccccc1CNCCC(=O)NCc1cccc(C)c1.
What is the InChIKey of 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide?
The InChIKey is HWGVMTUKQCBFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15-6-5-7-16(12-15)13-21-19(22)10-11-20-14-17-8-3-4-9-18(17)23-2/h3-9,12,20H,10-11,13-14H2,1-2H3,(H,21,22).
What are the key properties of 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide?
3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide has a molecular weight of 312.41 g/mol, XLogP of 2.80, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenyl)methylamino]-N-[(3-methylphenyl)methyl]propanamide is sourced from PubChem (CID 109019419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).