N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide

C17H28N2O — CID 120651415

IUPACN-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide
SMILESCCN[C@H](C)CNC(=O)CCCCc1ccc(C)cc1
InChIInChI=1S/C17H28N2O/c1-4-18-15(3)13-19-17(20)8-6-5-7-16-11-9-14(2)10-12-16/h9-12,15,18H,4-8,13H2,1-3H3,(H,19,20)/t15-/m1/s1
InChIKeyPRKPQMIWQUJFQS-OAHLLOKOSA-N
MW276.42 g/mol
LogP2.82
Rot. Bonds9

About N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide

N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide (PubChem CID 120651415) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide
PubChem CID120651415
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide
SMILESCCN[C@H](C)CNC(=O)CCCCc1ccc(C)cc1
InChIInChI=1S/C17H28N2O/c1-4-18-15(3)13-19-17(20)8-6-5-7-16-11-9-14(2)10-12-16/h9-12,15,18H,4-8,13H2,1-3H3,(H,19,20)/t15-/m1/s1
InChIKeyPRKPQMIWQUJFQS-OAHLLOKOSA-N
XLogP2.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide
CID 120652211
3-(4-tert-butylphenyl)-N-[(2R)-2-(ethylamino)propyl]propanamide
CID 120652975
2-methyl-3-[4-(4-methylphenyl)butanoylamino]propanoic acid
CID 119236583
N-(2-amino-2-phenylethyl)-5-(4-methylphenyl)pentanamide
CID 119527817
N-(2-amino-2-oxoethyl)-5-(4-methylphenyl)pentanamide
CID 56784821
N-[(2R)-2-hydroxypropyl]-3-(4-methylphenyl)propanamide
CID 83032441
N-(2-methylpropyl)-5-phenylpentanamide
CID 110297876
N-[(2R)-2-(ethylamino)propyl]-3-thiophen-3-ylpropanamide
CID 120653069
butanoic acid;N-butyl-5-(4-methylphenyl)pentanamide
CID 178048626
4-(4-methylphenyl)-N-(2-piperidin-1-ylpropyl)butanamide
CID 110301716
3-[4-(diethylsulfamoyl)phenyl]-N-[(2R)-2-(ethylamino)propyl]propanamide;hydrochloride
CID 120654006
methyl (2S)-2-[5-(4-methylphenyl)pentanoylamino]propanoate
CID 86865868

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide (CID 120651415) is N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide is CCN[C@H](C)CNC(=O)CCCCc1ccc(C)cc1.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide?
The InChIKey is PRKPQMIWQUJFQS-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-18-15(3)13-19-17(20)8-6-5-7-16-11-9-14(2)10-12-16/h9-12,15,18H,4-8,13H2,1-3H3,(H,19,20)/t15-/m1/s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide?
N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide has a molecular weight of 276.42 g/mol, XLogP of 2.82, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide is sourced from PubChem (CID 120651415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).