[1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol

C15H29NO2 — CID 55055811

IUPAC[1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol
SMILESCCCOC1CCCN(CC2(CO)CCCC2)C1
InChIInChI=1S/C15H29NO2/c1-2-10-18-14-6-5-9-16(11-14)12-15(13-17)7-3-4-8-15/h14,17H,2-13H2,1H3
InChIKeyPPUTXXBAHTUBQR-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.43
Rot. Bonds6

About [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol

[1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol (PubChem CID 55055811) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol
PubChem CID55055811
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name[1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol
SMILESCCCOC1CCCN(CC2(CO)CCCC2)C1
InChIInChI=1S/C15H29NO2/c1-2-10-18-14-6-5-9-16(11-14)12-15(13-17)7-3-4-8-15/h14,17H,2-13H2,1H3
InChIKeyPPUTXXBAHTUBQR-UHFFFAOYSA-N
XLogP2.43
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol?
The IUPAC name of [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol (CID 55055811) is [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol is CCCOC1CCCN(CC2(CO)CCCC2)C1.
What is the InChIKey of [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol?
The InChIKey is PPUTXXBAHTUBQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-2-10-18-14-6-5-9-16(11-14)12-15(13-17)7-3-4-8-15/h14,17H,2-13H2,1H3.
What are the key properties of [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol?
[1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol has a molecular weight of 255.40 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-propoxypiperidin-1-yl)methyl]cyclopentyl]methanol is sourced from PubChem (CID 55055811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).