1-amino-2-methylbutan-2-ol

C5H13NO — CID 3016656

IUPAC1-amino-2-methylbutan-2-ol
SMILESCCC(C)(O)CN
InChIInChI=1S/C5H13NO/c1-3-5(2,7)4-6/h7H,3-4,6H2,1-2H3
InChIKeyLHYVEOGDJNQNEW-UHFFFAOYSA-N
MW103.16 g/mol
LogP0.11
Rot. Bonds2

About 1-amino-2-methylbutan-2-ol

1-amino-2-methylbutan-2-ol (PubChem CID 3016656) has the molecular formula C5H13NO and a molecular weight of 103.16 g/mol. Its IUPAC name is 1-amino-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-amino-2-methylbutan-2-ol
PubChem CID3016656
Molecular FormulaC5H13NO
Molecular Weight103.16 g/mol
Exact Mass103.10
IUPAC Name1-amino-2-methylbutan-2-ol
SMILESCCC(C)(O)CN
InChIInChI=1S/C5H13NO/c1-3-5(2,7)4-6/h7H,3-4,6H2,1-2H3
InChIKeyLHYVEOGDJNQNEW-UHFFFAOYSA-N
XLogP0.11
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.16
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methylbutan-2-ol?
The IUPAC name of 1-amino-2-methylbutan-2-ol (CID 3016656) is 1-amino-2-methylbutan-2-ol.
What is the SMILES notation for 1-amino-2-methylbutan-2-ol?
The canonical SMILES for 1-amino-2-methylbutan-2-ol is CCC(C)(O)CN.
What is the InChIKey of 1-amino-2-methylbutan-2-ol?
The InChIKey is LHYVEOGDJNQNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-3-5(2,7)4-6/h7H,3-4,6H2,1-2H3.
What are the key properties of 1-amino-2-methylbutan-2-ol?
1-amino-2-methylbutan-2-ol has a molecular weight of 103.16 g/mol, XLogP of 0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methylbutan-2-ol is sourced from PubChem (CID 3016656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).