N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide

C6H11N3O3S — CID 102693499

IUPACN-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide
SMILESC[C@@H](O)CNS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C6H11N3O3S/c1-5(10)4-8-13(11,12)6-2-3-7-9-6/h2-3,5,8,10H,4H2,1H3,(H,7,9)/t5-/m1/s1
InChIKeyYONYLGQJDPWKHW-RXMQYKEDSA-N
MW205.24 g/mol
LogP-0.93
Rot. Bonds4

About N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide

N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide (PubChem CID 102693499) has the molecular formula C6H11N3O3S and a molecular weight of 205.24 g/mol. Its IUPAC name is N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide
PubChem CID102693499
Molecular FormulaC6H11N3O3S
Molecular Weight205.24 g/mol
Exact Mass205.05
IUPAC NameN-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide
SMILESC[C@@H](O)CNS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C6H11N3O3S/c1-5(10)4-8-13(11,12)6-2-3-7-9-6/h2-3,5,8,10H,4H2,1H3,(H,7,9)/t5-/m1/s1
InChIKeyYONYLGQJDPWKHW-RXMQYKEDSA-N
XLogP-0.93
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 5-0.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxypentyl)-1H-pyrazole-5-sulfonamide
CID 102693400
N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide
CID 114168833
4-methyl-5-(1H-pyrazol-5-ylsulfonylamino)pentanoic acid
CID 102690942
N-(3-methyl-2-oxobutyl)-1H-pyrazole-5-sulfonamide
CID 102691239
N-(2-amino-4,4-dimethylpentyl)-1H-pyrazole-5-sulfonamide
CID 107158984
N-(4-aminopentyl)-1H-pyrazole-5-sulfonamide
CID 106125806
N-(4-amino-2-ethylbutyl)-1H-pyrazole-5-sulfonamide
CID 102694126
2-(1H-pyrazol-5-ylsulfonylamino)acetic acid
CID 102690627
N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-1H-pyrazole-5-sulfonamide
CID 102692383
N-[2-(2-methylpropoxy)ethyl]-1H-pyrazole-5-sulfonamide
CID 102693440
N-(3-propan-2-yloxypropyl)-1H-pyrazole-5-sulfonamide
CID 102692436
N-(1-methylsulfonylpropan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102693096

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide (CID 102693499) is N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide is C[C@@H](O)CNS(=O)(=O)c1ccn[nH]1.
What is the InChIKey of N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide?
The InChIKey is YONYLGQJDPWKHW-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11N3O3S/c1-5(10)4-8-13(11,12)6-2-3-7-9-6/h2-3,5,8,10H,4H2,1H3,(H,7,9)/t5-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide?
N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide has a molecular weight of 205.24 g/mol, XLogP of -0.93, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102693499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).