2-cyclopropyl-2-hydroxybutanamide;hydrochloride

C7H14ClNO2 — CID 68852332

IUPAC2-cyclopropyl-2-hydroxybutanamide;hydrochloride
SMILESCCC(O)(C(N)=O)C1CC1.Cl
InChIInChI=1S/C7H13NO2.ClH/c1-2-7(10,6(8)9)5-3-4-5;/h5,10H,2-4H2,1H3,(H2,8,9);1H
InChIKeySKHWXTPYQCLTQH-UHFFFAOYSA-N
MW179.65 g/mol
LogP0.44
Rot. Bonds3

About 2-cyclopropyl-2-hydroxybutanamide;hydrochloride

2-cyclopropyl-2-hydroxybutanamide;hydrochloride (PubChem CID 68852332) has the molecular formula C7H14ClNO2 and a molecular weight of 179.65 g/mol. Its IUPAC name is 2-cyclopropyl-2-hydroxybutanamide;hydrochloride.

Molecular Properties

Compound Name2-cyclopropyl-2-hydroxybutanamide;hydrochloride
PubChem CID68852332
Molecular FormulaC7H14ClNO2
Molecular Weight179.65 g/mol
Exact Mass179.07
IUPAC Name2-cyclopropyl-2-hydroxybutanamide;hydrochloride
SMILESCCC(O)(C(N)=O)C1CC1.Cl
InChIInChI=1S/C7H13NO2.ClH/c1-2-7(10,6(8)9)5-3-4-5;/h5,10H,2-4H2,1H3,(H2,8,9);1H
InChIKeySKHWXTPYQCLTQH-UHFFFAOYSA-N
XLogP0.44
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.65
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-hydroxybutanamide;hydrochloride?
The IUPAC name of 2-cyclopropyl-2-hydroxybutanamide;hydrochloride (CID 68852332) is 2-cyclopropyl-2-hydroxybutanamide;hydrochloride.
What is the SMILES notation for 2-cyclopropyl-2-hydroxybutanamide;hydrochloride?
The canonical SMILES for 2-cyclopropyl-2-hydroxybutanamide;hydrochloride is CCC(O)(C(N)=O)C1CC1.Cl.
What is the InChIKey of 2-cyclopropyl-2-hydroxybutanamide;hydrochloride?
The InChIKey is SKHWXTPYQCLTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2.ClH/c1-2-7(10,6(8)9)5-3-4-5;/h5,10H,2-4H2,1H3,(H2,8,9);1H.
What are the key properties of 2-cyclopropyl-2-hydroxybutanamide;hydrochloride?
2-cyclopropyl-2-hydroxybutanamide;hydrochloride has a molecular weight of 179.65 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-hydroxybutanamide;hydrochloride is sourced from PubChem (CID 68852332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).