3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol

C11H23NO — CID 19097422

IUPAC3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol
SMILESCC(C)N1CCCC(CCCO)C1
InChIInChI=1S/C11H23NO/c1-10(2)12-7-3-5-11(9-12)6-4-8-13/h10-11,13H,3-9H2,1-2H3
InChIKeyUWMWONUXOZFKIU-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.88
Rot. Bonds4

About 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol

3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol (PubChem CID 19097422) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol.

Molecular Properties

Compound Name3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol
PubChem CID19097422
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol
SMILESCC(C)N1CCCC(CCCO)C1
InChIInChI=1S/C11H23NO/c1-10(2)12-7-3-5-11(9-12)6-4-8-13/h10-11,13H,3-9H2,1-2H3
InChIKeyUWMWONUXOZFKIU-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol?
The IUPAC name of 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol (CID 19097422) is 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol.
What is the SMILES notation for 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol?
The canonical SMILES for 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol is CC(C)N1CCCC(CCCO)C1.
What is the InChIKey of 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol?
The InChIKey is UWMWONUXOZFKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-10(2)12-7-3-5-11(9-12)6-4-8-13/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol?
3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-propan-2-ylpiperidin-3-yl)propan-1-ol is sourced from PubChem (CID 19097422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).