N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide

C10H19N3O3S — CID 114168833

IUPACN-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide
SMILESCCC(CC)C(O)CNS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C10H19N3O3S/c1-3-8(4-2)9(14)7-12-17(15,16)10-5-6-11-13-10/h5-6,8-9,12,14H,3-4,7H2,1-2H3,(H,11,13)
InChIKeySFWJGPPNGOAWJA-UHFFFAOYSA-N
MW261.35 g/mol
LogP0.49
Rot. Bonds7

About N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide

N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide (PubChem CID 114168833) has the molecular formula C10H19N3O3S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide
PubChem CID114168833
Molecular FormulaC10H19N3O3S
Molecular Weight261.35 g/mol
Exact Mass261.11
IUPAC NameN-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide
SMILESCCC(CC)C(O)CNS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C10H19N3O3S/c1-3-8(4-2)9(14)7-12-17(15,16)10-5-6-11-13-10/h5-6,8-9,12,14H,3-4,7H2,1-2H3,(H,11,13)
InChIKeySFWJGPPNGOAWJA-UHFFFAOYSA-N
XLogP0.49
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,3,3-trifluoro-2-hydroxypropyl)-1H-pyrazole-5-sulfonamide
CID 105648413
N-(3,3-difluoro-2-hydroxypropyl)-1H-pyrazole-5-sulfonamide
CID 105648420
N-(2-hydroxyethyl)-1H-pyrazole-5-sulfonamide
CID 102691881
N-(2-cyclopropyl-2-hydroxyethyl)-1H-pyrazole-4-sulfonamide
CID 63298975
N-(2-ethylbutyl)-1H-pyrazole-5-sulfonamide
CID 102691010
N-(3-methylbutyl)-1H-pyrazole-5-sulfonamide
CID 102691491
N-(4-hydroxycyclohexyl)-1H-pyrazole-5-sulfonamide
CID 102691559
1-(1H-pyrazol-5-ylsulfonyl)piperidin-4-ol
CID 102691566
N-(oxolan-2-ylmethyl)-1H-pyrazole-5-sulfonamide
CID 102691594
[1-(1H-pyrazol-5-ylsulfonyl)piperidin-4-yl]methanol
CID 102691610
N-(5-methylhexan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102691717
1-(1H-pyrazol-5-ylsulfonyl)piperidin-3-ol
CID 102691721

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide (CID 114168833) is N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide is CCC(CC)C(O)CNS(=O)(=O)c1ccn[nH]1.
What is the InChIKey of N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide?
The InChIKey is SFWJGPPNGOAWJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3S/c1-3-8(4-2)9(14)7-12-17(15,16)10-5-6-11-13-10/h5-6,8-9,12,14H,3-4,7H2,1-2H3,(H,11,13).
What are the key properties of N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide?
N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide has a molecular weight of 261.35 g/mol, XLogP of 0.49, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 114168833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).