2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride

C16H27ClN2O — CID 119788074

IUPAC2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCCc1c(C)cccc1C.Cl
InChIInChI=1S/C16H26N2O.ClH/c1-5-10-16(4,17)15(19)18-11-9-14-12(2)7-6-8-13(14)3;/h6-8H,5,9-11,17H2,1-4H3,(H,18,19);1H
InChIKeyBNHIESHGVZEZCM-UHFFFAOYSA-N
MW298.86 g/mol
LogP2.90
Rot. Bonds6

About 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride

2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride (PubChem CID 119788074) has the molecular formula C16H27ClN2O and a molecular weight of 298.86 g/mol. Its IUPAC name is 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride
PubChem CID119788074
Molecular FormulaC16H27ClN2O
Molecular Weight298.86 g/mol
Exact Mass298.18
IUPAC Name2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCCc1c(C)cccc1C.Cl
InChIInChI=1S/C16H26N2O.ClH/c1-5-10-16(4,17)15(19)18-11-9-14-12(2)7-6-8-13(14)3;/h6-8H,5,9-11,17H2,1-4H3,(H,18,19);1H
InChIKeyBNHIESHGVZEZCM-UHFFFAOYSA-N
XLogP2.90
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.86
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;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

2-amino-2-methyl-N-(2-naphthalen-1-ylethyl)pentanamide;hydrochloride
CID 119722534
2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride
CID 119688573
2-amino-2-methyl-N-(2-thiophen-2-ylethyl)pentanamide
CID 60847685
2-amino-2-methyl-N-(3-phenylpropyl)pentanamide;hydrochloride
CID 119674817
2-amino-N-[2-(4-fluorophenyl)ethyl]-2-methylpentanamide
CID 60847510
2-amino-2-methyl-N-(2-pyridin-2-ylethyl)pentanamide
CID 60846982
3-[2-[(2-amino-2-methylpentanoyl)amino]ethyl]benzamide
CID 119770336
N-[2-[(2-amino-2-methylpentanoyl)amino]ethyl]benzamide
CID 119702770
2-amino-2-methyl-N-[2-(4-nitrophenyl)ethyl]pentanamide;hydrochloride
CID 119745886
2-amino-2-methyl-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]pentanamide;hydrochloride
CID 119721542
2-amino-N-(2-hydroxyethyl)-2-methylpentanamide
CID 60847863
2-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-2-methylpentanamide
CID 119693075

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride (CID 119788074) is 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride is CCCC(C)(N)C(=O)NCCc1c(C)cccc1C.Cl.
What is the InChIKey of 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride?
The InChIKey is BNHIESHGVZEZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O.ClH/c1-5-10-16(4,17)15(19)18-11-9-14-12(2)7-6-8-13(14)3;/h6-8H,5,9-11,17H2,1-4H3,(H,18,19);1H.
What are the key properties of 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride?
2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride has a molecular weight of 298.86 g/mol, XLogP of 2.90, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride is sourced from PubChem (CID 119788074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).