3-hydroxypentanamide;hydrochloride

C5H12ClNO2 — CID 174591125

IUPAC3-hydroxypentanamide;hydrochloride
SMILESCCC(O)CC(N)=O.Cl
InChIInChI=1S/C5H11NO2.ClH/c1-2-4(7)3-5(6)8;/h4,7H,2-3H2,1H3,(H2,6,8);1H
InChIKeyLQKXKNFSKINWOU-UHFFFAOYSA-N
MW153.61 g/mol
LogP0.05
Rot. Bonds3

About 3-hydroxypentanamide;hydrochloride

3-hydroxypentanamide;hydrochloride (PubChem CID 174591125) has the molecular formula C5H12ClNO2 and a molecular weight of 153.61 g/mol. Its IUPAC name is 3-hydroxypentanamide;hydrochloride.

Molecular Properties

Compound Name3-hydroxypentanamide;hydrochloride
PubChem CID174591125
Molecular FormulaC5H12ClNO2
Molecular Weight153.61 g/mol
Exact Mass153.06
IUPAC Name3-hydroxypentanamide;hydrochloride
SMILESCCC(O)CC(N)=O.Cl
InChIInChI=1S/C5H11NO2.ClH/c1-2-4(7)3-5(6)8;/h4,7H,2-3H2,1H3,(H2,6,8);1H
InChIKeyLQKXKNFSKINWOU-UHFFFAOYSA-N
XLogP0.05
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.61
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxypentanamide;hydrochloride?
The IUPAC name of 3-hydroxypentanamide;hydrochloride (CID 174591125) is 3-hydroxypentanamide;hydrochloride.
What is the SMILES notation for 3-hydroxypentanamide;hydrochloride?
The canonical SMILES for 3-hydroxypentanamide;hydrochloride is CCC(O)CC(N)=O.Cl.
What is the InChIKey of 3-hydroxypentanamide;hydrochloride?
The InChIKey is LQKXKNFSKINWOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2.ClH/c1-2-4(7)3-5(6)8;/h4,7H,2-3H2,1H3,(H2,6,8);1H.
What are the key properties of 3-hydroxypentanamide;hydrochloride?
3-hydroxypentanamide;hydrochloride has a molecular weight of 153.61 g/mol, XLogP of 0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxypentanamide;hydrochloride is sourced from PubChem (CID 174591125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).