4-amino-2-methylpentan-2-ol

C6H15NO — CID 12542085

IUPAC4-amino-2-methylpentan-2-ol
SMILESCC(N)CC(C)(C)O
InChIInChI=1S/C6H15NO/c1-5(7)4-6(2,3)8/h5,8H,4,7H2,1-3H3
InChIKeyLYLPRVUTJGLNPP-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.49
Rot. Bonds2

About 4-amino-2-methylpentan-2-ol

4-amino-2-methylpentan-2-ol (PubChem CID 12542085) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 4-amino-2-methylpentan-2-ol.

Molecular Properties

Compound Name4-amino-2-methylpentan-2-ol
PubChem CID12542085
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name4-amino-2-methylpentan-2-ol
SMILESCC(N)CC(C)(C)O
InChIInChI=1S/C6H15NO/c1-5(7)4-6(2,3)8/h5,8H,4,7H2,1-3H3
InChIKeyLYLPRVUTJGLNPP-UHFFFAOYSA-N
XLogP0.49
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-Amino-2-methylbutan-2-ol
CID 15649173
(3S)-3-Amino-2,4-dimethylpentan-2-ol
CID 55280976
5-Amino-2-methyl-2-hexanol
CID 294499
5-Amino-2-methylpentan-2-ol
CID 22735029
Rac-(1r,3s)-3-amino-1-methylcyclobutan-1-ol hydrochloride
CID 72208024
4-Amino-3-ethylhexan-3-ol
CID 18515394
3-Amino-1-methylcyclobutan-1-ol
CID 68052608
(1s,3r)-3-Amino-1-ethylcyclobutan-1-ol
CID 80561372
(R)-3-amino-2-methyl-pentan-2-ol
CID 12112803
3-Amino-2,4-dimethylpentan-2-ol
CID 13247948
2-Methyl-4-(methylamino)pentan-2-ol
CID 14690640
3-Amino-2-methylhexan-2-ol
CID 20323471

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-methylpentan-2-ol?
The IUPAC name of 4-amino-2-methylpentan-2-ol (CID 12542085) is 4-amino-2-methylpentan-2-ol.
What is the SMILES notation for 4-amino-2-methylpentan-2-ol?
The canonical SMILES for 4-amino-2-methylpentan-2-ol is CC(N)CC(C)(C)O.
What is the InChIKey of 4-amino-2-methylpentan-2-ol?
The InChIKey is LYLPRVUTJGLNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-5(7)4-6(2,3)8/h5,8H,4,7H2,1-3H3.
What are the key properties of 4-amino-2-methylpentan-2-ol?
4-amino-2-methylpentan-2-ol has a molecular weight of 117.19 g/mol, XLogP of 0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-methylpentan-2-ol is sourced from PubChem (CID 12542085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).