4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride

C13H29ClN2O — CID 120563103

IUPAC4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride
SMILESCC(N)CCC(=O)NC(C)CCC(C)(C)C.Cl
InChIInChI=1S/C13H28N2O.ClH/c1-10(14)6-7-12(16)15-11(2)8-9-13(3,4)5;/h10-11H,6-9,14H2,1-5H3,(H,15,16);1H
InChIKeyCCWKXSUVCVNYIC-UHFFFAOYSA-N
MW264.84 g/mol
LogP2.87
Rot. Bonds6

About 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride

4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride (PubChem CID 120563103) has the molecular formula C13H29ClN2O and a molecular weight of 264.84 g/mol. Its IUPAC name is 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride
PubChem CID120563103
Molecular FormulaC13H29ClN2O
Molecular Weight264.84 g/mol
Exact Mass264.20
IUPAC Name4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride
SMILESCC(N)CCC(=O)NC(C)CCC(C)(C)C.Cl
InChIInChI=1S/C13H28N2O.ClH/c1-10(14)6-7-12(16)15-11(2)8-9-13(3,4)5;/h10-11H,6-9,14H2,1-5H3,(H,15,16);1H
InChIKeyCCWKXSUVCVNYIC-UHFFFAOYSA-N
XLogP2.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.84
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;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

7-amino-N-(5,5-dimethylhexan-2-yl)heptanamide
CID 119796530
4-amino-N-[3-(butan-2-ylamino)-3-oxopropyl]pentanamide;hydrochloride
CID 120560806
4-amino-N-(4-cyclohexylbutan-2-yl)pentanamide
CID 120562906
diethyl 2-(4-aminopentanoylamino)propanedioate;hydrochloride
CID 120559501
4-(2-aminoethyl)-N-(4-hydroxybutan-2-yl)-5,5-dimethylhexanamide
CID 83177791
(2S)-2-amino-N-(5,5-dimethylhexan-2-yl)-4-methylpentanamide
CID 119796588
2-(4-aminophenyl)-N-(5,5-dimethylhexan-2-yl)acetamide
CID 119796536
4,4,4-trifluoro-N-(4-hydroxybutan-2-yl)butanamide
CID 115283442
9-amino-2,2-dimethyldecan-5-one
CID 116610021
N-(5,5-dimethylhexan-2-yl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119796579
4-amino-N-[1-(3,5-dimethylphenyl)propan-2-yl]pentanamide
CID 120563508
tert-butyl (4R)-4-aminopentanoate
CID 58781983

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride?
The IUPAC name of 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride (CID 120563103) is 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride?
The canonical SMILES for 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride is CC(N)CCC(=O)NC(C)CCC(C)(C)C.Cl.
What is the InChIKey of 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride?
The InChIKey is CCWKXSUVCVNYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O.ClH/c1-10(14)6-7-12(16)15-11(2)8-9-13(3,4)5;/h10-11H,6-9,14H2,1-5H3,(H,15,16);1H.
What are the key properties of 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride?
4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride has a molecular weight of 264.84 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5,5-dimethylhexan-2-yl)pentanamide;hydrochloride is sourced from PubChem (CID 120563103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).