[1-(3-aminocyclopentyl)piperidin-4-yl]methanol

C11H22N2O — CID 79468998

IUPAC[1-(3-aminocyclopentyl)piperidin-4-yl]methanol
SMILESNC1CCC(N2CCC(CO)CC2)C1
InChIInChI=1S/C11H22N2O/c12-10-1-2-11(7-10)13-5-3-9(8-14)4-6-13/h9-11,14H,1-8,12H2
InChIKeyWOMBWGQVYOOCSE-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.57
Rot. Bonds2

About [1-(3-aminocyclopentyl)piperidin-4-yl]methanol

[1-(3-aminocyclopentyl)piperidin-4-yl]methanol (PubChem CID 79468998) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [1-(3-aminocyclopentyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(3-aminocyclopentyl)piperidin-4-yl]methanol
PubChem CID79468998
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[1-(3-aminocyclopentyl)piperidin-4-yl]methanol
SMILESNC1CCC(N2CCC(CO)CC2)C1
InChIInChI=1S/C11H22N2O/c12-10-1-2-11(7-10)13-5-3-9(8-14)4-6-13/h9-11,14H,1-8,12H2
InChIKeyWOMBWGQVYOOCSE-UHFFFAOYSA-N
XLogP0.57
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(3-aminocyclopentyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(3-aminocyclopentyl)piperidin-4-yl]methanol (CID 79468998) is [1-(3-aminocyclopentyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(3-aminocyclopentyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(3-aminocyclopentyl)piperidin-4-yl]methanol is NC1CCC(N2CCC(CO)CC2)C1.
What is the InChIKey of [1-(3-aminocyclopentyl)piperidin-4-yl]methanol?
The InChIKey is WOMBWGQVYOOCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c12-10-1-2-11(7-10)13-5-3-9(8-14)4-6-13/h9-11,14H,1-8,12H2.
What are the key properties of [1-(3-aminocyclopentyl)piperidin-4-yl]methanol?
[1-(3-aminocyclopentyl)piperidin-4-yl]methanol has a molecular weight of 198.31 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-aminocyclopentyl)piperidin-4-yl]methanol is sourced from PubChem (CID 79468998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).