1-hydroxy-3-methylpiperidin-4-amine

C6H14N2O — CID 70254159

IUPAC1-hydroxy-3-methylpiperidin-4-amine
SMILESCC1CN(O)CCC1N
InChIInChI=1S/C6H14N2O/c1-5-4-8(9)3-2-6(5)7/h5-6,9H,2-4,7H2,1H3
InChIKeyXKSJLBFHGIQCSY-UHFFFAOYSA-N
MW130.19 g/mol
LogP0.04
Rot. Bonds

About 1-hydroxy-3-methylpiperidin-4-amine

1-hydroxy-3-methylpiperidin-4-amine (PubChem CID 70254159) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is 1-hydroxy-3-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-hydroxy-3-methylpiperidin-4-amine
PubChem CID70254159
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name1-hydroxy-3-methylpiperidin-4-amine
SMILESCC1CN(O)CCC1N
InChIInChI=1S/C6H14N2O/c1-5-4-8(9)3-2-6(5)7/h5-6,9H,2-4,7H2,1H3
InChIKeyXKSJLBFHGIQCSY-UHFFFAOYSA-N
XLogP0.04
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3-methylpiperidin-4-amine?
The IUPAC name of 1-hydroxy-3-methylpiperidin-4-amine (CID 70254159) is 1-hydroxy-3-methylpiperidin-4-amine.
What is the SMILES notation for 1-hydroxy-3-methylpiperidin-4-amine?
The canonical SMILES for 1-hydroxy-3-methylpiperidin-4-amine is CC1CN(O)CCC1N.
What is the InChIKey of 1-hydroxy-3-methylpiperidin-4-amine?
The InChIKey is XKSJLBFHGIQCSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-5-4-8(9)3-2-6(5)7/h5-6,9H,2-4,7H2,1H3.
What are the key properties of 1-hydroxy-3-methylpiperidin-4-amine?
1-hydroxy-3-methylpiperidin-4-amine has a molecular weight of 130.19 g/mol, XLogP of 0.04, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3-methylpiperidin-4-amine is sourced from PubChem (CID 70254159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).