hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine

C5H13ClN4O3S — CID 90745357

IUPAChydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine
SMILESCS(=O)(=O)Cl.Cc1cc(N)n[nH]1.NO
InChIInChI=1S/C4H7N3.CH3ClO2S.H3NO/c1-3-2-4(5)7-6-3;1-5(2,3)4;1-2/h2H,1H3,(H3,5,6,7);1H3;2H,1H2
InChIKeyLNJWKNAGXAVAKX-UHFFFAOYSA-N
MW244.70 g/mol
LogP-0.18
Rot. Bonds

About hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine

hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine (PubChem CID 90745357) has the molecular formula C5H13ClN4O3S and a molecular weight of 244.70 g/mol. Its IUPAC name is hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Namehydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine
PubChem CID90745357
Molecular FormulaC5H13ClN4O3S
Molecular Weight244.70 g/mol
Exact Mass244.04
IUPAC Namehydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine
SMILESCS(=O)(=O)Cl.Cc1cc(N)n[nH]1.NO
InChIInChI=1S/C4H7N3.CH3ClO2S.H3NO/c1-3-2-4(5)7-6-3;1-5(2,3)4;1-2/h2H,1H3,(H3,5,6,7);1H3;2H,1H2
InChIKeyLNJWKNAGXAVAKX-UHFFFAOYSA-N
XLogP-0.18
TPSA135.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.70
LogP ≤ 5-0.18
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine?
The IUPAC name of hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine (CID 90745357) is hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine.
What is the SMILES notation for hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine?
The canonical SMILES for hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine is CS(=O)(=O)Cl.Cc1cc(N)n[nH]1.NO.
What is the InChIKey of hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine?
The InChIKey is LNJWKNAGXAVAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3.CH3ClO2S.H3NO/c1-3-2-4(5)7-6-3;1-5(2,3)4;1-2/h2H,1H3,(H3,5,6,7);1H3;2H,1H2.
What are the key properties of hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine?
hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine has a molecular weight of 244.70 g/mol, XLogP of -0.18, 0 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxylamine;methanesulfonyl chloride;5-methyl-1H-pyrazol-3-amine is sourced from PubChem (CID 90745357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).