N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide

C10H17N3O2S — CID 107414868

IUPACN-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide
SMILESCC1CCC(CNS(=O)(=O)c2ccn[nH]2)C1
InChIInChI=1S/C10H17N3O2S/c1-8-2-3-9(6-8)7-12-16(14,15)10-4-5-11-13-10/h4-5,8-9,12H,2-3,6-7H2,1H3,(H,11,13)
InChIKeyBOXGIKMANUIABE-UHFFFAOYSA-N
MW243.33 g/mol
LogP1.12
Rot. Bonds4

About N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide

N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide (PubChem CID 107414868) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide
PubChem CID107414868
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC NameN-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide
SMILESCC1CCC(CNS(=O)(=O)c2ccn[nH]2)C1
InChIInChI=1S/C10H17N3O2S/c1-8-2-3-9(6-8)7-12-16(14,15)10-4-5-11-13-10/h4-5,8-9,12H,2-3,6-7H2,1H3,(H,11,13)
InChIKeyBOXGIKMANUIABE-UHFFFAOYSA-N
XLogP1.12
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-1H-pyrazole-5-sulfonamide
CID 102691651
N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide
CID 102693146
N-[(2-methylcyclohexyl)methyl]-1H-pyrazole-5-sulfonamide
CID 102692871
N-(thiolan-3-ylmethyl)-1H-pyrazole-5-sulfonamide
CID 107297786
N-[(1,1-dioxothiolan-3-yl)methyl]-1H-pyrazole-5-sulfonamide
CID 102692339
N-(oxan-3-ylmethyl)-1H-pyrazole-5-sulfonamide
CID 102692335
N-[(5-oxopyrrolidin-2-yl)methyl]-1H-pyrazole-5-sulfonamide
CID 102693077
N-[(3-methylcyclopentyl)methyl]-2,3-dihydro-1H-indole-5-sulfonamide
CID 107414189
2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107411108
2-chloro-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107412513
N-(1-cyclopropylbutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102693054
6-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107411147

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide (CID 107414868) is N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide is CC1CCC(CNS(=O)(=O)c2ccn[nH]2)C1.
What is the InChIKey of N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide?
The InChIKey is BOXGIKMANUIABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c1-8-2-3-9(6-8)7-12-16(14,15)10-4-5-11-13-10/h4-5,8-9,12H,2-3,6-7H2,1H3,(H,11,13).
What are the key properties of N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide?
N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide has a molecular weight of 243.33 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 107414868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).