1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol

C10H22N2O — CID 82405643

IUPAC1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol
SMILESCC(C)C(CN)N1CCC(O)CC1
InChIInChI=1S/C10H22N2O/c1-8(2)10(7-11)12-5-3-9(13)4-6-12/h8-10,13H,3-7,11H2,1-2H3
InChIKeyOWNRCEDURMFFLD-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.43
Rot. Bonds3

About 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol

1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol (PubChem CID 82405643) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol
PubChem CID82405643
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol
SMILESCC(C)C(CN)N1CCC(O)CC1
InChIInChI=1S/C10H22N2O/c1-8(2)10(7-11)12-5-3-9(13)4-6-12/h8-10,13H,3-7,11H2,1-2H3
InChIKeyOWNRCEDURMFFLD-UHFFFAOYSA-N
XLogP0.43
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol?
The IUPAC name of 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol (CID 82405643) is 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol.
What is the SMILES notation for 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol?
The canonical SMILES for 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol is CC(C)C(CN)N1CCC(O)CC1.
What is the InChIKey of 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol?
The InChIKey is OWNRCEDURMFFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-8(2)10(7-11)12-5-3-9(13)4-6-12/h8-10,13H,3-7,11H2,1-2H3.
What are the key properties of 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol?
1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol has a molecular weight of 186.30 g/mol, XLogP of 0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol is sourced from PubChem (CID 82405643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).