N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide

C10H18N4O2S — CID 113443991

IUPACN-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide
SMILESCn1nccc1S(=O)(=O)NC1CCCCC1N
InChIInChI=1S/C10H18N4O2S/c1-14-10(6-7-12-14)17(15,16)13-9-5-3-2-4-8(9)11/h6-9,13H,2-5,11H2,1H3
InChIKeyPITKLDDMLVNMNL-UHFFFAOYSA-N
MW258.35 g/mol
LogP-0.03
Rot. Bonds3

About N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide

N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide (PubChem CID 113443991) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide
PubChem CID113443991
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC NameN-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide
SMILESCn1nccc1S(=O)(=O)NC1CCCCC1N
InChIInChI=1S/C10H18N4O2S/c1-14-10(6-7-12-14)17(15,16)13-9-5-3-2-4-8(9)11/h6-9,13H,2-5,11H2,1H3
InChIKeyPITKLDDMLVNMNL-UHFFFAOYSA-N
XLogP-0.03
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-2-methylpyrazole-3-sulfonamide
CID 104709770
2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 104709662
N-(4-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide;hydrochloride
CID 120708226
N-[4-(bromomethyl)cyclohexyl]-2-methylpyrazole-3-sulfonamide
CID 112753047
2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide
CID 104709475
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-methylpyrazole-3-sulfonamide
CID 104710290
N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-2-methylpyrazole-3-sulfonamide
CID 128511768
N-[2-(cycloheptylamino)ethyl]-2-methylpyrazole-3-sulfonamide
CID 104710326
N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide
CID 114146761
methyl 4-[(2-methylpyrazol-3-yl)sulfonylamino]cyclohexane-1-carboxylate
CID 104710389
N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-2-methylpyrazole-3-sulfonamide
CID 129003579
N-[(1S,2S)-2-aminocyclohexyl]-4-methylbenzenesulfonamide;benzene;ruthenium
CID 87792352

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide?
The IUPAC name of N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide (CID 113443991) is N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide.
What is the SMILES notation for N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide?
The canonical SMILES for N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide is Cn1nccc1S(=O)(=O)NC1CCCCC1N.
What is the InChIKey of N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide?
The InChIKey is PITKLDDMLVNMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-14-10(6-7-12-14)17(15,16)13-9-5-3-2-4-8(9)11/h6-9,13H,2-5,11H2,1H3.
What are the key properties of N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide?
N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide has a molecular weight of 258.35 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide is sourced from PubChem (CID 113443991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).