4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide

C15H26N4O — CID 65358575

IUPAC4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide
SMILESCCC(NC(=O)c1c(N)cnn1CC)C1CCCCC1
InChIInChI=1S/C15H26N4O/c1-3-13(11-8-6-5-7-9-11)18-15(20)14-12(16)10-17-19(14)4-2/h10-11,13H,3-9,16H2,1-2H3,(H,18,20)
InChIKeyXZNHXLGBIDKNLS-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.57
Rot. Bonds5

About 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide

4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide (PubChem CID 65358575) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide
PubChem CID65358575
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide
SMILESCCC(NC(=O)c1c(N)cnn1CC)C1CCCCC1
InChIInChI=1S/C15H26N4O/c1-3-13(11-8-6-5-7-9-11)18-15(20)14-12(16)10-17-19(14)4-2/h10-11,13H,3-9,16H2,1-2H3,(H,18,20)
InChIKeyXZNHXLGBIDKNLS-UHFFFAOYSA-N
XLogP2.57
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-cyclopropyl-1-ethylpyrazole-5-carboxamide
CID 65356982
4-amino-N-(1-cyclohexylpropyl)-1H-pyrazole-5-carboxamide
CID 55179184
4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide
CID 65354049
4-amino-N-(1,1-dioxothiolan-3-yl)-1-ethylpyrazole-5-carboxamide
CID 65357083
4-amino-1-ethyl-N-[2-(hydroxymethyl)cyclohexyl]pyrazole-5-carboxamide
CID 106358691
4-amino-1-ethyl-N-[(2-methylcyclohexyl)methyl]pyrazole-5-carboxamide
CID 65358665
4-amino-1-ethyl-N-(1-hydroxy-3-methylbutan-2-yl)pyrazole-5-carboxamide
CID 79248487
2-amino-N-(1-cyclohexylpropyl)-1,3-oxazole-5-carboxamide
CID 167984557
N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide
CID 95288937
4-amino-1-ethyl-N-(4-methylpent-1-yn-3-yl)pyrazole-5-carboxamide
CID 114201947
4-amino-1-ethyl-N-(thiolan-3-yl)pyrazole-5-carboxamide
CID 103062218
4-amino-1-ethyl-N-(1-hydroxy-4,4-dimethylpentan-3-yl)pyrazole-5-carboxamide
CID 106347925

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide (CID 65358575) is 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide is CCC(NC(=O)c1c(N)cnn1CC)C1CCCCC1.
What is the InChIKey of 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide?
The InChIKey is XZNHXLGBIDKNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-3-13(11-8-6-5-7-9-11)18-15(20)14-12(16)10-17-19(14)4-2/h10-11,13H,3-9,16H2,1-2H3,(H,18,20).
What are the key properties of 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide?
4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-cyclohexylpropyl)-1-ethylpyrazole-5-carboxamide is sourced from PubChem (CID 65358575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).