4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide

C15H27N3O2 — CID 121184730

IUPAC4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide
SMILESO=C(NC1CCOCC1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H27N3O2/c19-15(16-13-5-11-20-12-6-13)18-9-7-17(8-10-18)14-3-1-2-4-14/h13-14H,1-12H2,(H,16,19)
InChIKeyAECYJCAGPCFECJ-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.44
Rot. Bonds2

About 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide

4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide (PubChem CID 121184730) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide
PubChem CID121184730
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide
SMILESO=C(NC1CCOCC1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H27N3O2/c19-15(16-13-5-11-20-12-6-13)18-9-7-17(8-10-18)14-3-1-2-4-14/h13-14H,1-12H2,(H,16,19)
InChIKeyAECYJCAGPCFECJ-UHFFFAOYSA-N
XLogP1.44
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
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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Related Compounds

N-cyclohexyl-4-(oxetan-3-yl)piperazine-1-carboxamide
CID 153404857
N-(oxolan-3-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide
CID 115760770
N-cyclohexyl-4-(oxetan-3-yl)piperazine-1-carboxamide;ethane
CID 153404856
N-cyclohexyl-3-morpholin-4-ylpiperidine-1-carboxamide
CID 45248209
4-(oxan-4-yl)-N-(4-phenylcyclohexyl)piperazine-1-carboxamide
CID 126784702
N-cyclohexyl-4-piperidin-1-ylpiperidine-1-carboxamide
CID 23604706
4-(2,2-dimethylpropanoyl)-N-(oxepan-4-yl)piperazine-1-carboxamide
CID 127754010
1-(oxan-4-ylcarbamoyl)piperidine-4-carboxylic acid
CID 43610485
N-cycloheptyl-4-(1,1-dioxothiolan-3-yl)piperazine-1-carboxamide
CID 113109610
N-cyclopropyl-1,4-oxazepane-4-carboxamide
CID 115597922
4-[(4-cyclopropylpiperazine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 61443231
N-cyclopentyl-4-morpholin-4-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91919078

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide?
The IUPAC name of 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide (CID 121184730) is 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide is O=C(NC1CCOCC1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide?
The InChIKey is AECYJCAGPCFECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c19-15(16-13-5-11-20-12-6-13)18-9-7-17(8-10-18)14-3-1-2-4-14/h13-14H,1-12H2,(H,16,19).
What are the key properties of 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide?
4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-(oxan-4-yl)piperazine-1-carboxamide is sourced from PubChem (CID 121184730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).