pentanamide;hydrochloride

C5H12ClNO — CID 19817493

IUPACpentanamide;hydrochloride
SMILESCCCCC(N)=O.Cl
InChIInChI=1S/C5H11NO.ClH/c1-2-3-4-5(6)7;/h2-4H2,1H3,(H2,6,7);1H
InChIKeyWIYDEVSKVYFPPV-UHFFFAOYSA-N
MW137.61 g/mol
LogP1.08
Rot. Bonds3

About pentanamide;hydrochloride

pentanamide;hydrochloride (PubChem CID 19817493) has the molecular formula C5H12ClNO and a molecular weight of 137.61 g/mol. Its IUPAC name is pentanamide;hydrochloride.

Molecular Properties

Compound Namepentanamide;hydrochloride
PubChem CID19817493
Molecular FormulaC5H12ClNO
Molecular Weight137.61 g/mol
Exact Mass137.06
IUPAC Namepentanamide;hydrochloride
SMILESCCCCC(N)=O.Cl
InChIInChI=1S/C5H11NO.ClH/c1-2-3-4-5(6)7;/h2-4H2,1H3,(H2,6,7);1H
InChIKeyWIYDEVSKVYFPPV-UHFFFAOYSA-N
XLogP1.08
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.61
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of pentanamide;hydrochloride?
The IUPAC name of pentanamide;hydrochloride (CID 19817493) is pentanamide;hydrochloride.
What is the SMILES notation for pentanamide;hydrochloride?
The canonical SMILES for pentanamide;hydrochloride is CCCCC(N)=O.Cl.
What is the InChIKey of pentanamide;hydrochloride?
The InChIKey is WIYDEVSKVYFPPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.ClH/c1-2-3-4-5(6)7;/h2-4H2,1H3,(H2,6,7);1H.
What are the key properties of pentanamide;hydrochloride?
pentanamide;hydrochloride has a molecular weight of 137.61 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pentanamide;hydrochloride is sourced from PubChem (CID 19817493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).