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

C8H13N3O3S — CID 102693146

IUPACN-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide
SMILESO=S(=O)(NCC1CC(O)C1)c1ccn[nH]1
InChIInChI=1S/C8H13N3O3S/c12-7-3-6(4-7)5-10-15(13,14)8-1-2-9-11-8/h1-2,6-7,10,12H,3-5H2,(H,9,11)
InChIKeyQEDUVQPNLNJCGI-UHFFFAOYSA-N
MW231.28 g/mol
LogP-0.54
Rot. Bonds4

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

N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide (PubChem CID 102693146) has the molecular formula C8H13N3O3S and a molecular weight of 231.28 g/mol. Its IUPAC name is N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide
PubChem CID102693146
Molecular FormulaC8H13N3O3S
Molecular Weight231.28 g/mol
Exact Mass231.07
IUPAC NameN-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide
SMILESO=S(=O)(NCC1CC(O)C1)c1ccn[nH]1
InChIInChI=1S/C8H13N3O3S/c12-7-3-6(4-7)5-10-15(13,14)8-1-2-9-11-8/h1-2,6-7,10,12H,3-5H2,(H,9,11)
InChIKeyQEDUVQPNLNJCGI-UHFFFAOYSA-N
XLogP-0.54
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclohexylmethyl)-1H-pyrazole-5-sulfonamide
CID 102691651
N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide
CID 107414868
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-[(2-methylcyclohexyl)methyl]-1H-pyrazole-5-sulfonamide
CID 102692871
N-[(5-oxopyrrolidin-2-yl)methyl]-1H-pyrazole-5-sulfonamide
CID 102693077
N-cyclopropyl-2-(1H-pyrazol-5-ylsulfonylamino)acetamide
CID 102691693
N-[(3-hydroxycyclobutyl)methyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 66006522
2-(1H-pyrazol-5-ylsulfonylamino)acetic acid
CID 102690627
N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide
CID 102693499
N-prop-2-enyl-1H-pyrazole-5-sulfonamide
CID 102690992

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide (CID 102693146) is N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide is O=S(=O)(NCC1CC(O)C1)c1ccn[nH]1.
What is the InChIKey of N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide?
The InChIKey is QEDUVQPNLNJCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O3S/c12-7-3-6(4-7)5-10-15(13,14)8-1-2-9-11-8/h1-2,6-7,10,12H,3-5H2,(H,9,11).
What are the key properties of N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide?
N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide has a molecular weight of 231.28 g/mol, XLogP of -0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102693146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).