2-methylpropanamide;hydrochloride

C4H10ClNO — CID 22560783

IUPAC2-methylpropanamide;hydrochloride
SMILESCC(C)C(N)=O.Cl
InChIInChI=1S/C4H9NO.ClH/c1-3(2)4(5)6;/h3H,1-2H3,(H2,5,6);1H
InChIKeyGZVUWANWWQXKQR-UHFFFAOYSA-N
MW123.58 g/mol
LogP0.55
Rot. Bonds1

About 2-methylpropanamide;hydrochloride

2-methylpropanamide;hydrochloride (PubChem CID 22560783) has the molecular formula C4H10ClNO and a molecular weight of 123.58 g/mol. Its IUPAC name is 2-methylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-methylpropanamide;hydrochloride
PubChem CID22560783
Molecular FormulaC4H10ClNO
Molecular Weight123.58 g/mol
Exact Mass123.05
IUPAC Name2-methylpropanamide;hydrochloride
SMILESCC(C)C(N)=O.Cl
InChIInChI=1S/C4H9NO.ClH/c1-3(2)4(5)6;/h3H,1-2H3,(H2,5,6);1H
InChIKeyGZVUWANWWQXKQR-UHFFFAOYSA-N
XLogP0.55
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.58
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropanamide;hydrochloride?
The IUPAC name of 2-methylpropanamide;hydrochloride (CID 22560783) is 2-methylpropanamide;hydrochloride.
What is the SMILES notation for 2-methylpropanamide;hydrochloride?
The canonical SMILES for 2-methylpropanamide;hydrochloride is CC(C)C(N)=O.Cl.
What is the InChIKey of 2-methylpropanamide;hydrochloride?
The InChIKey is GZVUWANWWQXKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.ClH/c1-3(2)4(5)6;/h3H,1-2H3,(H2,5,6);1H.
What are the key properties of 2-methylpropanamide;hydrochloride?
2-methylpropanamide;hydrochloride has a molecular weight of 123.58 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropanamide;hydrochloride is sourced from PubChem (CID 22560783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).