1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol

C14H27NO2 — CID 16876972

IUPAC1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol
SMILESCC1CCN(CC(O)COC2CCCC2)CC1
InChIInChI=1S/C14H27NO2/c1-12-6-8-15(9-7-12)10-13(16)11-17-14-4-2-3-5-14/h12-14,16H,2-11H2,1H3
InChIKeyDRCDKLVAHDUKDX-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.04
Rot. Bonds5

About 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol

1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol (PubChem CID 16876972) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol
PubChem CID16876972
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol
SMILESCC1CCN(CC(O)COC2CCCC2)CC1
InChIInChI=1S/C14H27NO2/c1-12-6-8-15(9-7-12)10-13(16)11-17-14-4-2-3-5-14/h12-14,16H,2-11H2,1H3
InChIKeyDRCDKLVAHDUKDX-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol?
The IUPAC name of 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol (CID 16876972) is 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol is CC1CCN(CC(O)COC2CCCC2)CC1.
What is the InChIKey of 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol?
The InChIKey is DRCDKLVAHDUKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12-6-8-15(9-7-12)10-13(16)11-17-14-4-2-3-5-14/h12-14,16H,2-11H2,1H3.
What are the key properties of 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol?
1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol has a molecular weight of 241.37 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 16876972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).