2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride

C12H27ClN2O — CID 3024587

IUPAC2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
SMILESCN(C)CC(=O)NC(C)(C)CC(C)(C)C.Cl
InChIInChI=1S/C12H26N2O.ClH/c1-11(2,3)9-12(4,5)13-10(15)8-14(6)7;/h8-9H2,1-7H3,(H,13,15);1H
InChIKeyGEEXJHIBQKXGRH-UHFFFAOYSA-N
MW250.81 g/mol
LogP2.30
Rot. Bonds4

About 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride

2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride (PubChem CID 3024587) has the molecular formula C12H27ClN2O and a molecular weight of 250.81 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
PubChem CID3024587
Molecular FormulaC12H27ClN2O
Molecular Weight250.81 g/mol
Exact Mass250.18
IUPAC Name2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
SMILESCN(C)CC(=O)NC(C)(C)CC(C)(C)C.Cl
InChIInChI=1S/C12H26N2O.ClH/c1-11(2,3)9-12(4,5)13-10(15)8-14(6)7;/h8-9H2,1-7H3,(H,13,15);1H
InChIKeyGEEXJHIBQKXGRH-UHFFFAOYSA-N
XLogP2.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.81
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
The IUPAC name of 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride (CID 3024587) is 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride is CN(C)CC(=O)NC(C)(C)CC(C)(C)C.Cl.
What is the InChIKey of 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
The InChIKey is GEEXJHIBQKXGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O.ClH/c1-11(2,3)9-12(4,5)13-10(15)8-14(6)7;/h8-9H2,1-7H3,(H,13,15);1H.
What are the key properties of 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride has a molecular weight of 250.81 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride is sourced from PubChem (CID 3024587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).