4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol

C10H21NO2 — CID 130703735

IUPAC4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol
SMILESCC(C)CN1CCC(CO)C(O)C1
InChIInChI=1S/C10H21NO2/c1-8(2)5-11-4-3-9(7-12)10(13)6-11/h8-10,12-13H,3-7H2,1-2H3
InChIKeyZAARIKVUQOUHKY-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.32
Rot. Bonds3

About 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol

4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol (PubChem CID 130703735) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol.

Molecular Properties

Compound Name4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol
PubChem CID130703735
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol
SMILESCC(C)CN1CCC(CO)C(O)C1
InChIInChI=1S/C10H21NO2/c1-8(2)5-11-4-3-9(7-12)10(13)6-11/h8-10,12-13H,3-7H2,1-2H3
InChIKeyZAARIKVUQOUHKY-UHFFFAOYSA-N
XLogP0.32
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol?
The IUPAC name of 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol (CID 130703735) is 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol.
What is the SMILES notation for 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol?
The canonical SMILES for 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol is CC(C)CN1CCC(CO)C(O)C1.
What is the InChIKey of 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol?
The InChIKey is ZAARIKVUQOUHKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(2)5-11-4-3-9(7-12)10(13)6-11/h8-10,12-13H,3-7H2,1-2H3.
What are the key properties of 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol?
4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol has a molecular weight of 187.28 g/mol, XLogP of 0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-1-(2-methylpropyl)piperidin-3-ol is sourced from PubChem (CID 130703735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).