2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide

C15H28N2O2 — CID 119035061

IUPAC2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide
SMILESNC(=O)CC1CCCN(CC(O)CC2CCCC2)C1
InChIInChI=1S/C15H28N2O2/c16-15(19)9-13-6-3-7-17(10-13)11-14(18)8-12-4-1-2-5-12/h12-14,18H,1-11H2,(H2,16,19)
InChIKeyNOVHDYAIMOKXQK-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.51
Rot. Bonds6

About 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide

2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide (PubChem CID 119035061) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide
PubChem CID119035061
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide
SMILESNC(=O)CC1CCCN(CC(O)CC2CCCC2)C1
InChIInChI=1S/C15H28N2O2/c16-15(19)9-13-6-3-7-17(10-13)11-14(18)8-12-4-1-2-5-12/h12-14,18H,1-11H2,(H2,16,19)
InChIKeyNOVHDYAIMOKXQK-UHFFFAOYSA-N
XLogP1.51
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide?
The IUPAC name of 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide (CID 119035061) is 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide.
What is the SMILES notation for 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide?
The canonical SMILES for 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide is NC(=O)CC1CCCN(CC(O)CC2CCCC2)C1.
What is the InChIKey of 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide?
The InChIKey is NOVHDYAIMOKXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c16-15(19)9-13-6-3-7-17(10-13)11-14(18)8-12-4-1-2-5-12/h12-14,18H,1-11H2,(H2,16,19).
What are the key properties of 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide?
2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide has a molecular weight of 268.40 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 119035061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).