4,4-dimethylpentanamide;hydrochloride

C7H16ClNO — CID 141202343

IUPAC4,4-dimethylpentanamide;hydrochloride
SMILESCC(C)(C)CCC(N)=O.Cl
InChIInChI=1S/C7H15NO.ClH/c1-7(2,3)5-4-6(8)9;/h4-5H2,1-3H3,(H2,8,9);1H
InChIKeySDLQPQDXDSKDJU-UHFFFAOYSA-N
MW165.66 g/mol
LogP1.72
Rot. Bonds2

About 4,4-dimethylpentanamide;hydrochloride

4,4-dimethylpentanamide;hydrochloride (PubChem CID 141202343) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is 4,4-dimethylpentanamide;hydrochloride.

Molecular Properties

Compound Name4,4-dimethylpentanamide;hydrochloride
PubChem CID141202343
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC Name4,4-dimethylpentanamide;hydrochloride
SMILESCC(C)(C)CCC(N)=O.Cl
InChIInChI=1S/C7H15NO.ClH/c1-7(2,3)5-4-6(8)9;/h4-5H2,1-3H3,(H2,8,9);1H
InChIKeySDLQPQDXDSKDJU-UHFFFAOYSA-N
XLogP1.72
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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5-methyl-5-sulfanylhexanamide
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CID 71436896

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethylpentanamide;hydrochloride?
The IUPAC name of 4,4-dimethylpentanamide;hydrochloride (CID 141202343) is 4,4-dimethylpentanamide;hydrochloride.
What is the SMILES notation for 4,4-dimethylpentanamide;hydrochloride?
The canonical SMILES for 4,4-dimethylpentanamide;hydrochloride is CC(C)(C)CCC(N)=O.Cl.
What is the InChIKey of 4,4-dimethylpentanamide;hydrochloride?
The InChIKey is SDLQPQDXDSKDJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-7(2,3)5-4-6(8)9;/h4-5H2,1-3H3,(H2,8,9);1H.
What are the key properties of 4,4-dimethylpentanamide;hydrochloride?
4,4-dimethylpentanamide;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethylpentanamide;hydrochloride is sourced from PubChem (CID 141202343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).