[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine

C10H17N5O2S — CID 79181055

IUPAC[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine
SMILESCC1CN(S(=O)(=O)c2cnc(NN)nc2)CC1C
InChIInChI=1S/C10H17N5O2S/c1-7-5-15(6-8(7)2)18(16,17)9-3-12-10(14-11)13-4-9/h3-4,7-8H,5-6,11H2,1-2H3,(H,12,13,14)
InChIKeyPHEMWVQKCAOART-UHFFFAOYSA-N
MW271.35 g/mol
LogP0.04
Rot. Bonds3

About [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine

[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine (PubChem CID 79181055) has the molecular formula C10H17N5O2S and a molecular weight of 271.35 g/mol. Its IUPAC name is [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine
PubChem CID79181055
Molecular FormulaC10H17N5O2S
Molecular Weight271.35 g/mol
Exact Mass271.11
IUPAC Name[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine
SMILESCC1CN(S(=O)(=O)c2cnc(NN)nc2)CC1C
InChIInChI=1S/C10H17N5O2S/c1-7-5-15(6-8(7)2)18(16,17)9-3-12-10(14-11)13-4-9/h3-4,7-8H,5-6,11H2,1-2H3,(H,12,13,14)
InChIKeyPHEMWVQKCAOART-UHFFFAOYSA-N
XLogP0.04
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine?
The IUPAC name of [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine (CID 79181055) is [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine is CC1CN(S(=O)(=O)c2cnc(NN)nc2)CC1C.
What is the InChIKey of [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine?
The InChIKey is PHEMWVQKCAOART-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2S/c1-7-5-15(6-8(7)2)18(16,17)9-3-12-10(14-11)13-4-9/h3-4,7-8H,5-6,11H2,1-2H3,(H,12,13,14).
What are the key properties of [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine?
[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine has a molecular weight of 271.35 g/mol, XLogP of 0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine is sourced from PubChem (CID 79181055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).