5-amino-3-methylpentan-1-ol

C6H15NO — CID 12040649

IUPAC5-amino-3-methylpentan-1-ol
SMILESCC(CCN)CCO
InChIInChI=1S/C6H15NO/c1-6(2-4-7)3-5-8/h6,8H,2-5,7H2,1H3
InChIKeyRGFWQLHALIZEQV-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.35
Rot. Bonds4

About 5-amino-3-methylpentan-1-ol

5-amino-3-methylpentan-1-ol (PubChem CID 12040649) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 5-amino-3-methylpentan-1-ol.

Molecular Properties

Compound Name5-amino-3-methylpentan-1-ol
PubChem CID12040649
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name5-amino-3-methylpentan-1-ol
SMILESCC(CCN)CCO
InChIInChI=1S/C6H15NO/c1-6(2-4-7)3-5-8/h6,8H,2-5,7H2,1H3
InChIKeyRGFWQLHALIZEQV-UHFFFAOYSA-N
XLogP0.35
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-methylpentan-1-ol?
The IUPAC name of 5-amino-3-methylpentan-1-ol (CID 12040649) is 5-amino-3-methylpentan-1-ol.
What is the SMILES notation for 5-amino-3-methylpentan-1-ol?
The canonical SMILES for 5-amino-3-methylpentan-1-ol is CC(CCN)CCO.
What is the InChIKey of 5-amino-3-methylpentan-1-ol?
The InChIKey is RGFWQLHALIZEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-6(2-4-7)3-5-8/h6,8H,2-5,7H2,1H3.
What are the key properties of 5-amino-3-methylpentan-1-ol?
5-amino-3-methylpentan-1-ol has a molecular weight of 117.19 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-methylpentan-1-ol is sourced from PubChem (CID 12040649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).