N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide

C19H24N2O2 — CID 119420670

IUPACN-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide
SMILESCOc1ccc(N)c(NC(=O)CC(c2ccccc2)C(C)C)c1
InChIInChI=1S/C19H24N2O2/c1-13(2)16(14-7-5-4-6-8-14)12-19(22)21-18-11-15(23-3)9-10-17(18)20/h4-11,13,16H,12,20H2,1-3H3,(H,21,22)
InChIKeyQYBWSPXCNANHKW-UHFFFAOYSA-N
MW312.41 g/mol
LogP4.05
Rot. Bonds6

About N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide

N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide (PubChem CID 119420670) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide.

Molecular Properties

Compound NameN-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide
PubChem CID119420670
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide
SMILESCOc1ccc(N)c(NC(=O)CC(c2ccccc2)C(C)C)c1
InChIInChI=1S/C19H24N2O2/c1-13(2)16(14-7-5-4-6-8-14)12-19(22)21-18-11-15(23-3)9-10-17(18)20/h4-11,13,16H,12,20H2,1-3H3,(H,21,22)
InChIKeyQYBWSPXCNANHKW-UHFFFAOYSA-N
XLogP4.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-5-methoxyphenyl)-4-(2-methoxyphenyl)-3-methylbutanamide
CID 119420675
3-amino-N-(2,5-dimethoxyphenyl)-3-phenylpropanamide
CID 43822665
N-(2-amino-5-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 63257795
3-amino-N-(2-hydroxy-4-methoxyphenyl)-3-phenylpropanamide
CID 102695385
N-[2-(2-amino-5-methoxyanilino)-2-oxoethyl]-4-methylpentanamide;hydrochloride
CID 119420848
N-(2,5-dimethoxyphenyl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131563
[2-(2,5-dimethoxyanilino)-2-oxoethyl] 2,2-diphenylacetate
CID 4145246
N-(2-amino-5-methoxyphenyl)-5-(4-methoxyphenyl)-5-oxopentanamide
CID 119421073
N-(2-amino-5-methoxyphenyl)-2-(3-hydroxyphenyl)acetamide
CID 63257743
(3S)-N-(2,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-3-phenylpropanamide
CID 1309526
N-(2-amino-5-methoxyphenyl)-2-tert-butylsulfanylacetamide
CID 63257845
N-(2-amino-5-methoxyphenyl)-2-(3-bromophenyl)acetamide
CID 63257871

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide?
The IUPAC name of N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide (CID 119420670) is N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide.
What is the SMILES notation for N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide?
The canonical SMILES for N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide is COc1ccc(N)c(NC(=O)CC(c2ccccc2)C(C)C)c1.
What is the InChIKey of N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide?
The InChIKey is QYBWSPXCNANHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-13(2)16(14-7-5-4-6-8-14)12-19(22)21-18-11-15(23-3)9-10-17(18)20/h4-11,13,16H,12,20H2,1-3H3,(H,21,22).
What are the key properties of N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide?
N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide has a molecular weight of 312.41 g/mol, XLogP of 4.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide is sourced from PubChem (CID 119420670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).