[5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol

C13H25NO — CID 83916879

IUPAC[5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol
SMILESCC(C)CC1NCC(C2CC2)CC1CO
InChIInChI=1S/C13H25NO/c1-9(2)5-13-12(8-15)6-11(7-14-13)10-3-4-10/h9-15H,3-8H2,1-2H3
InChIKeyLGDBTUUXBFUSKJ-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.03
Rot. Bonds4

About [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol

[5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol (PubChem CID 83916879) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol
PubChem CID83916879
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name[5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol
SMILESCC(C)CC1NCC(C2CC2)CC1CO
InChIInChI=1S/C13H25NO/c1-9(2)5-13-12(8-15)6-11(7-14-13)10-3-4-10/h9-15H,3-8H2,1-2H3
InChIKeyLGDBTUUXBFUSKJ-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol?
The IUPAC name of [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol (CID 83916879) is [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol.
What is the SMILES notation for [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol?
The canonical SMILES for [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol is CC(C)CC1NCC(C2CC2)CC1CO.
What is the InChIKey of [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol?
The InChIKey is LGDBTUUXBFUSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-9(2)5-13-12(8-15)6-11(7-14-13)10-3-4-10/h9-15H,3-8H2,1-2H3.
What are the key properties of [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol?
[5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol has a molecular weight of 211.35 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-cyclopropyl-2-(2-methylpropyl)piperidin-3-yl]methanol is sourced from PubChem (CID 83916879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).