N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide

C16H31N3O — CID 78892600

IUPACN-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide
SMILESCC(C)CN1CCN(C(=O)NCCC2CCCC2)CC1
InChIInChI=1S/C16H31N3O/c1-14(2)13-18-9-11-19(12-10-18)16(20)17-8-7-15-5-3-4-6-15/h14-15H,3-13H2,1-2H3,(H,17,20)
InChIKeyOYVDZRBAMYSIJS-UHFFFAOYSA-N
MW281.44 g/mol
LogP2.55
Rot. Bonds5

About N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide

N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide (PubChem CID 78892600) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide
PubChem CID78892600
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide
SMILESCC(C)CN1CCN(C(=O)NCCC2CCCC2)CC1
InChIInChI=1S/C16H31N3O/c1-14(2)13-18-9-11-19(12-10-18)16(20)17-8-7-15-5-3-4-6-15/h14-15H,3-13H2,1-2H3,(H,17,20)
InChIKeyOYVDZRBAMYSIJS-UHFFFAOYSA-N
XLogP2.55
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(2-cyclopentylethylcarbamoyl)piperazin-1-yl]acetic acid
CID 61205575
N-ethyl-4-(2-methylpropyl)piperazine-1-carboxamide
CID 115569927
N-(2-cyclopropylethyl)pyrrolidine-1-carboxamide
CID 54293585
N-(3-cyclohexylpropyl)-4-ethylpiperazine-1-carboxamide
CID 112837772
4-(2-methylpropyl)-N-[2-(propan-2-ylsulfamoyl)ethyl]piperazine-1-carboxamide
CID 122156185
N-(2-cyclopentylethyl)-3,5-dimethylpiperidine-1-carboxamide
CID 55808732
1-(2-cyclopentylethyl)-3-(2-methyl-3-piperidin-1-ylpropyl)urea
CID 55933177
cyclohexyl-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 113072857
N-(2-cyclooctylethyl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazine-1-carboxamide
CID 121495008
N-(2-cyclobutylethyl)-1-(2-methylpropyl)piperidin-4-amine
CID 103914513
N-(2-cyclohexylethyl)-3-hydroxypiperidine-1-carboxamide
CID 110896376
N-(2-cyclopentylethyl)-2-methylmorpholine-4-carboxamide
CID 78892468

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide?
The IUPAC name of N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide (CID 78892600) is N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide?
The canonical SMILES for N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide is CC(C)CN1CCN(C(=O)NCCC2CCCC2)CC1.
What is the InChIKey of N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide?
The InChIKey is OYVDZRBAMYSIJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-14(2)13-18-9-11-19(12-10-18)16(20)17-8-7-15-5-3-4-6-15/h14-15H,3-13H2,1-2H3,(H,17,20).
What are the key properties of N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide?
N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide has a molecular weight of 281.44 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide is sourced from PubChem (CID 78892600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).