N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide

C19H24N2O — CID 109030922

IUPACN-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide
SMILESCc1ccccc1NC(=O)CCNCCCc1ccccc1
InChIInChI=1S/C19H24N2O/c1-16-8-5-6-12-18(16)21-19(22)13-15-20-14-7-11-17-9-3-2-4-10-17/h2-6,8-10,12,20H,7,11,13-15H2,1H3,(H,21,22)
InChIKeyGVOVBOUYRXCCHA-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.55
Rot. Bonds8

About N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide

N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide (PubChem CID 109030922) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide
PubChem CID109030922
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide
SMILESCc1ccccc1NC(=O)CCNCCCc1ccccc1
InChIInChI=1S/C19H24N2O/c1-16-8-5-6-12-18(16)21-19(22)13-15-20-14-7-11-17-9-3-2-4-10-17/h2-6,8-10,12,20H,7,11,13-15H2,1H3,(H,21,22)
InChIKeyGVOVBOUYRXCCHA-UHFFFAOYSA-N
XLogP3.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.55
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

N-(2-methylphenyl)-3-(pentylamino)propanamide
CID 109032228
ethane;N-(3-phenylpropyl)-3-(3-phenylpropylamino)propanamide
CID 142168077
N-(2-ethylphenyl)-3-(2-phenylethylamino)propanamide
CID 109024292
N-(3-acetamidophenyl)-3-(3-phenylpropylamino)propanamide
CID 109030973
N-(2,4-dimethoxyphenyl)-3-(3-phenylpropylamino)propanamide
CID 109030966
3-(3-phenylpropylamino)-N-(4-propan-2-ylphenyl)propanamide
CID 109030939
N-butyl-3-(3-phenylpropylamino)propanamide
CID 109012240
N-(2-methyl-6-propan-2-ylphenyl)-3-(2-phenylethylamino)propanamide
CID 109024299
N-(3-chloro-2-methylphenyl)-2-(3-phenylpropylamino)acetamide
CID 109005057
4-(methylamino)-N-(2-methylphenyl)butanamide;hydrochloride
CID 119670453
4-N-(2-methylphenyl)-1-N-(3-phenylpropyl)cyclohexane-1,4-dicarboxamide
CID 109149525
N-(2,3-dimethylphenyl)-3-[2-(4-fluorophenyl)ethylamino]propanamide
CID 109025134

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide?
The IUPAC name of N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide (CID 109030922) is N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide.
What is the SMILES notation for N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide?
The canonical SMILES for N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide is Cc1ccccc1NC(=O)CCNCCCc1ccccc1.
What is the InChIKey of N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide?
The InChIKey is GVOVBOUYRXCCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-16-8-5-6-12-18(16)21-19(22)13-15-20-14-7-11-17-9-3-2-4-10-17/h2-6,8-10,12,20H,7,11,13-15H2,1H3,(H,21,22).
What are the key properties of N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide?
N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide has a molecular weight of 296.41 g/mol, XLogP of 3.55, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-3-(3-phenylpropylamino)propanamide is sourced from PubChem (CID 109030922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).