4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide

C14H25N3O2 — CID 81478709

IUPAC4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide
SMILESCC1CCC(C(=O)NCC(=O)N2CCNCC2)CC1
InChIInChI=1S/C14H25N3O2/c1-11-2-4-12(5-3-11)14(19)16-10-13(18)17-8-6-15-7-9-17/h11-12,15H,2-10H2,1H3,(H,16,19)
InChIKeyGLIINJIWFZKCIG-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.36
Rot. Bonds3

About 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide

4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide (PubChem CID 81478709) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide
PubChem CID81478709
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide
SMILESCC1CCC(C(=O)NCC(=O)N2CCNCC2)CC1
InChIInChI=1S/C14H25N3O2/c1-11-2-4-12(5-3-11)14(19)16-10-13(18)17-8-6-15-7-9-17/h11-12,15H,2-10H2,1H3,(H,16,19)
InChIKeyGLIINJIWFZKCIG-UHFFFAOYSA-N
XLogP0.36
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-oxo-2-piperazin-1-ylethyl)cyclohexanecarboxamide;hydrochloride
CID 119260097
2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-3-carboxamide
CID 79760319
(4-methylcyclohexyl)-piperazin-1-ylmethanone
CID 22229215
1-acetyl-N-(2-oxo-2-piperidin-1-ylethyl)piperidine-4-carboxamide
CID 110741930
N-(3,3-difluoro-2-oxopropyl)-4-methylcyclohexane-1-carboxamide
CID 153456408
1-(2-oxo-2-piperazin-1-ylethyl)-3-propan-2-ylurea
CID 61176089
2-ethyl-N-(2-oxo-2-piperazin-1-ylethyl)butanamide
CID 28708756
2-methylsulfanyl-N-(2-oxo-2-piperazin-1-ylethyl)acetamide
CID 61176260
N-(2-bromoprop-2-enyl)-4-methylcyclohexane-1-carboxamide
CID 115647439
4-methyl-N-(2-oxo-2-piperidin-1-ylethyl)piperidine-1-carboxamide
CID 115583845
N-(2-oxo-2-piperazin-1-ylethyl)-1,4-dioxane-2-carboxamide
CID 61175302
tert-butyl 4-[2-(cyclopropanecarbonylamino)acetyl]-1,4-diazepane-1-carboxylate
CID 95752747

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide (CID 81478709) is 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide is CC1CCC(C(=O)NCC(=O)N2CCNCC2)CC1.
What is the InChIKey of 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide?
The InChIKey is GLIINJIWFZKCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-11-2-4-12(5-3-11)14(19)16-10-13(18)17-8-6-15-7-9-17/h11-12,15H,2-10H2,1H3,(H,16,19).
What are the key properties of 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide?
4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 81478709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).