2-Butanamine, 2-methyl-, hydrochloride

C5H14ClN — CID 12441534

IUPAC2-methylbutan-2-amine;hydrochloride
SMILESCCC(C)(C)N.Cl
InChIInChI=1S/C5H13N.ClH/c1-4-5(2,3)6;/h4,6H2,1-3H3;1H
InChIKeyLPZRMKGBALTKKP-UHFFFAOYSA-N
MW123.62 g/mol
LogP—
Rot. Bonds1

About 2-Butanamine, 2-methyl-, hydrochloride

2-Butanamine, 2-methyl-, hydrochloride (PubChem CID 12441534) has the molecular formula C5H14ClN and a molecular weight of 123.62 g/mol. Its IUPAC name is 2-methylbutan-2-amine;hydrochloride.

Molecular Properties

Compound Name2-Butanamine, 2-methyl-, hydrochloride
PubChem CID12441534
Molecular FormulaC5H14ClN
Molecular Weight123.62 g/mol
Exact Mass123.08
IUPAC Name2-methylbutan-2-amine;hydrochloride
SMILESCCC(C)(C)N.Cl
InChIInChI=1S/C5H13N.ClH/c1-4-5(2,3)6;/h4,6H2,1-3H3;1H
InChIKeyLPZRMKGBALTKKP-UHFFFAOYSA-N
XLogP—
TPSA26.00 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity39

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-Butanamine, 2-methyl-, hydrochloride?
The IUPAC name of 2-Butanamine, 2-methyl-, hydrochloride (CID 12441534) is 2-methylbutan-2-amine;hydrochloride.
What is the SMILES notation for 2-Butanamine, 2-methyl-, hydrochloride?
The canonical SMILES for 2-Butanamine, 2-methyl-, hydrochloride is CCC(C)(C)N.Cl.
What is the InChIKey of 2-Butanamine, 2-methyl-, hydrochloride?
The InChIKey is LPZRMKGBALTKKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.ClH/c1-4-5(2,3)6;/h4,6H2,1-3H3;1H.
What are the key properties of 2-Butanamine, 2-methyl-, hydrochloride?
2-Butanamine, 2-methyl-, hydrochloride has a molecular weight of 123.62 g/mol, XLogP of not available, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Butanamine, 2-methyl-, hydrochloride is sourced from PubChem (CID 12441534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).