4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide

C15H27N3O2 — CID 17185121

IUPAC4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide
SMILESO=C(NCC1CCCO1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H27N3O2/c19-15(16-12-14-6-3-11-20-14)18-9-7-17(8-10-18)13-4-1-2-5-13/h13-14H,1-12H2,(H,16,19)
InChIKeyUFNDMPJDDWSEKF-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.44
Rot. Bonds3

About 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide

4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide (PubChem CID 17185121) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide
PubChem CID17185121
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide
SMILESO=C(NCC1CCCO1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H27N3O2/c19-15(16-12-14-6-3-11-20-14)18-9-7-17(8-10-18)13-4-1-2-5-13/h13-14H,1-12H2,(H,16,19)
InChIKeyUFNDMPJDDWSEKF-UHFFFAOYSA-N
XLogP1.44
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide?
The IUPAC name of 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide (CID 17185121) is 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide?
The canonical SMILES for 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide is O=C(NCC1CCCO1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide?
The InChIKey is UFNDMPJDDWSEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c19-15(16-12-14-6-3-11-20-14)18-9-7-17(8-10-18)13-4-1-2-5-13/h13-14H,1-12H2,(H,16,19).
What are the key properties of 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide?
4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-(oxolan-2-ylmethyl)piperazine-1-carboxamide is sourced from PubChem (CID 17185121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).