N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride

C17H29ClN2O — CID 119668250

IUPACN-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride
SMILESCCCCC(CN)NC(=O)CC(CC)c1ccccc1.Cl
InChIInChI=1S/C17H28N2O.ClH/c1-3-5-11-16(13-18)19-17(20)12-14(4-2)15-9-7-6-8-10-15;/h6-10,14,16H,3-5,11-13,18H2,1-2H3,(H,19,20);1H
InChIKeyFMHZNNKROSGBAM-UHFFFAOYSA-N
MW312.88 g/mol
LogP3.63
Rot. Bonds9

About N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride

N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride (PubChem CID 119668250) has the molecular formula C17H29ClN2O and a molecular weight of 312.88 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride
PubChem CID119668250
Molecular FormulaC17H29ClN2O
Molecular Weight312.88 g/mol
Exact Mass312.20
IUPAC NameN-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride
SMILESCCCCC(CN)NC(=O)CC(CC)c1ccccc1.Cl
InChIInChI=1S/C17H28N2O.ClH/c1-3-5-11-16(13-18)19-17(20)12-14(4-2)15-9-7-6-8-10-15;/h6-10,14,16H,3-5,11-13,18H2,1-2H3,(H,19,20);1H
InChIKeyFMHZNNKROSGBAM-UHFFFAOYSA-N
XLogP3.63
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.88
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride 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

3-amino-N-octan-4-yl-3-phenylpropanamide
CID 103823881
N-(1-aminohexan-2-yl)-2-methylsulfanyl-2-phenylacetamide
CID 119667243
N-(1-aminohexan-2-yl)-3-methylpentanamide
CID 114875681
N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride
CID 119667896
N-(1-aminohexan-2-yl)-2-(2-methylphenyl)acetamide
CID 80697183
(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid
CID 119368014
(2S)-2-(3-phenylpentanoylamino)propanoic acid
CID 119238309
N-(1-aminohexan-2-yl)-2-(2,6-dimethylanilino)acetamide
CID 119668833
N-(1-amino-4-methylpentan-2-yl)-3-(4-methylphenyl)pentanamide
CID 119585731
3-acetamido-N-(1-aminohexan-2-yl)-3-(4-methylphenyl)propanamide
CID 119668025
N-[4-(1-aminohexan-2-ylamino)-4-oxobutyl]benzamide
CID 119668614
N-[1-(1-aminohexan-2-ylamino)-3-methyl-1-oxopentan-2-yl]benzamide;hydrochloride
CID 119665970

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride (CID 119668250) is N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride is CCCCC(CN)NC(=O)CC(CC)c1ccccc1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride?
The InChIKey is FMHZNNKROSGBAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O.ClH/c1-3-5-11-16(13-18)19-17(20)12-14(4-2)15-9-7-6-8-10-15;/h6-10,14,16H,3-5,11-13,18H2,1-2H3,(H,19,20);1H.
What are the key properties of N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride?
N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride has a molecular weight of 312.88 g/mol, XLogP of 3.63, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride is sourced from PubChem (CID 119668250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).