N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide

C10H15N3O2 — CID 110467692

IUPACN-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
SMILESO=C1CC(C(=O)NC2CCCCC2)=NN1
InChIInChI=1S/C10H15N3O2/c14-9-6-8(12-13-9)10(15)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,11,15)(H,13,14)
InChIKeyQZXJKGOHKGTEKU-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.31
Rot. Bonds2

About N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide

N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide (PubChem CID 110467692) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
PubChem CID110467692
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
SMILESO=C1CC(C(=O)NC2CCCCC2)=NN1
InChIInChI=1S/C10H15N3O2/c14-9-6-8(12-13-9)10(15)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,11,15)(H,13,14)
InChIKeyQZXJKGOHKGTEKU-UHFFFAOYSA-N
XLogP0.31
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,1-dioxothiolan-3-yl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467785
N-(4-methylcyclohexyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 4881394
N-[1-(cyclohexylmethyl)piperidin-3-yl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 45186564
N-(2-cyclopropylpyrimidin-5-yl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 167766294
N-tert-butyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467674
N-[3-(cyclopropylamino)-3-oxopropyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 79395899
N-(2-cyclopentylethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60734317
N-[cyano(cyclohexyl)methyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 103727953
N-cyclohexyl-1H-pyrazole-4-carboxamide
CID 43532859
N-cyclohexyl-5-oxo-1,2-dihydropyrazole-3-carboxamide
CID 112513809
4-N,6-N-dicyclohexylpyrimidine-4,6-dicarboxamide
CID 131994880
N-benzyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467706

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide (CID 110467692) is N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide is O=C1CC(C(=O)NC2CCCCC2)=NN1.
What is the InChIKey of N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide?
The InChIKey is QZXJKGOHKGTEKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c14-9-6-8(12-13-9)10(15)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,11,15)(H,13,14).
What are the key properties of N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide?
N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-oxo-1,4-dihydropyrazole-3-carboxamide is sourced from PubChem (CID 110467692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).