N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide

C13H20N4O3S — CID 65374364

IUPACN-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
SMILESNS(=O)(=O)c1c(C(=O)NC2CCCCC2)n[nH]c1C1CC1
InChIInChI=1S/C13H20N4O3S/c14-21(19,20)12-10(8-6-7-8)16-17-11(12)13(18)15-9-4-2-1-3-5-9/h8-9H,1-7H2,(H,15,18)(H,16,17)(H2,14,19,20)
InChIKeyFDDGDYPOZSOVML-UHFFFAOYSA-N
MW312.40 g/mol
LogP1.00
Rot. Bonds4

About N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide

N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide (PubChem CID 65374364) has the molecular formula C13H20N4O3S and a molecular weight of 312.40 g/mol. Its IUPAC name is N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
PubChem CID65374364
Molecular FormulaC13H20N4O3S
Molecular Weight312.40 g/mol
Exact Mass312.13
IUPAC NameN-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
SMILESNS(=O)(=O)c1c(C(=O)NC2CCCCC2)n[nH]c1C1CC1
InChIInChI=1S/C13H20N4O3S/c14-21(19,20)12-10(8-6-7-8)16-17-11(12)13(18)15-9-4-2-1-3-5-9/h8-9H,1-7H2,(H,15,18)(H,16,17)(H2,14,19,20)
InChIKeyFDDGDYPOZSOVML-UHFFFAOYSA-N
XLogP1.00
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.40
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide (CID 65374364) is N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide is NS(=O)(=O)c1c(C(=O)NC2CCCCC2)n[nH]c1C1CC1.
What is the InChIKey of N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The InChIKey is FDDGDYPOZSOVML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3S/c14-21(19,20)12-10(8-6-7-8)16-17-11(12)13(18)15-9-4-2-1-3-5-9/h8-9H,1-7H2,(H,15,18)(H,16,17)(H2,14,19,20).
What are the key properties of N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide has a molecular weight of 312.40 g/mol, XLogP of 1.00, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-cyclopropyl-4-sulfamoyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 65374364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).