N-cycloheptyl-1H-pyrazole-5-sulfonamide

C10H17N3O2S — CID 102691549

IUPACN-cycloheptyl-1H-pyrazole-5-sulfonamide
SMILESO=S(=O)(NC1CCCCCC1)c1ccn[nH]1
InChIInChI=1S/C10H17N3O2S/c14-16(15,10-7-8-11-12-10)13-9-5-3-1-2-4-6-9/h7-9,13H,1-6H2,(H,11,12)
InChIKeyCHJAIBSHUQZWMX-UHFFFAOYSA-N
MW243.33 g/mol
LogP1.41
Rot. Bonds3

About N-cycloheptyl-1H-pyrazole-5-sulfonamide

N-cycloheptyl-1H-pyrazole-5-sulfonamide (PubChem CID 102691549) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-cycloheptyl-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-cycloheptyl-1H-pyrazole-5-sulfonamide
PubChem CID102691549
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC NameN-cycloheptyl-1H-pyrazole-5-sulfonamide
SMILESO=S(=O)(NC1CCCCCC1)c1ccn[nH]1
InChIInChI=1S/C10H17N3O2S/c14-16(15,10-7-8-11-12-10)13-9-5-3-1-2-4-6-9/h7-9,13H,1-6H2,(H,11,12)
InChIKeyCHJAIBSHUQZWMX-UHFFFAOYSA-N
XLogP1.41
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclooctyl-1H-pyrazole-5-sulfonamide
CID 102691484
N-(4-bromocyclohexyl)-1H-pyrazole-5-sulfonamide
CID 102694021
N-[(3S)-piperidin-3-yl]-1H-pyrazole-5-sulfonamide
CID 102693697
N-[(1S,2S)-2-hydroxycyclohexyl]-1H-pyrazole-5-sulfonamide
CID 102739144
N-(cyclohexylmethyl)-1H-pyrazole-5-sulfonamide
CID 102691651
N-(2-amino-1-cyclohexylethyl)-1H-pyrazole-5-sulfonamide
CID 102690413
N-(2-methylcyclopropyl)-1H-pyrazole-5-sulfonamide
CID 102692944
N-[2-(bromomethyl)cyclopentyl]-1H-pyrazole-5-sulfonamide
CID 106367494
N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide
CID 102693183
N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrazole-5-sulfonamide
CID 106364162
N-(2,2-diethyloxan-4-yl)-1H-pyrazole-5-sulfonamide
CID 102693289
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-pyrazole-5-sulfonamide
CID 102692407

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-cycloheptyl-1H-pyrazole-5-sulfonamide (CID 102691549) is N-cycloheptyl-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-cycloheptyl-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-cycloheptyl-1H-pyrazole-5-sulfonamide is O=S(=O)(NC1CCCCCC1)c1ccn[nH]1.
What is the InChIKey of N-cycloheptyl-1H-pyrazole-5-sulfonamide?
The InChIKey is CHJAIBSHUQZWMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c14-16(15,10-7-8-11-12-10)13-9-5-3-1-2-4-6-9/h7-9,13H,1-6H2,(H,11,12).
What are the key properties of N-cycloheptyl-1H-pyrazole-5-sulfonamide?
N-cycloheptyl-1H-pyrazole-5-sulfonamide has a molecular weight of 243.33 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102691549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).