[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine

C10H12N4O2S — CID 165480871

IUPAC[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine
SMILESCS(=O)(=O)c1cnn(-c2cccnc2CN)c1
InChIInChI=1S/C10H12N4O2S/c1-17(15,16)8-6-13-14(7-8)10-3-2-4-12-9(10)5-11/h2-4,6-7H,5,11H2,1H3
InChIKeyJUESEYZZYWMKNS-UHFFFAOYSA-N
MW252.30 g/mol
LogP0.13
Rot. Bonds3

About [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine

[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine (PubChem CID 165480871) has the molecular formula C10H12N4O2S and a molecular weight of 252.30 g/mol. Its IUPAC name is [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine
PubChem CID165480871
Molecular FormulaC10H12N4O2S
Molecular Weight252.30 g/mol
Exact Mass252.07
IUPAC Name[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine
SMILESCS(=O)(=O)c1cnn(-c2cccnc2CN)c1
InChIInChI=1S/C10H12N4O2S/c1-17(15,16)8-6-13-14(7-8)10-3-2-4-12-9(10)5-11/h2-4,6-7H,5,11H2,1H3
InChIKeyJUESEYZZYWMKNS-UHFFFAOYSA-N
XLogP0.13
TPSA90.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(4-methylsulfonylpyrazol-1-yl)pyridine-2-carboximidamide
CID 165481001
[5-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine
CID 165472913
[6-(4-methylsulfonylpyrazol-1-yl)-3-pyridinyl]methanamine
CID 165472914
[3-chloro-2-(4-methylsulfonylpyrazol-1-yl)-4-pyridinyl]methanamine
CID 165472906
(1S)-1-[2-(4-methylsulfonylpyrazol-1-yl)-3-pyridinyl]ethanamine
CID 165477558
[3-[(4-methylsulfonylphenoxy)methyl]-2-pyridinyl]methanamine
CID 62895729
2-(chloromethyl)-5-(4-methylsulfonylpyrazol-1-yl)pyrazine
CID 165480513
3-amino-4-(4-methylsulfonylpyrazol-1-yl)benzamide
CID 165472831
[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol
CID 165472365
2-methyl-2-(4-methylsulfonylpyrazol-1-yl)propan-1-amine
CID 165472927
[3-[(3-methylsulfonylphenoxy)methyl]-2-pyridinyl]methanamine
CID 62895899
(1R)-1-[5-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]propan-1-amine
CID 165477516

Frequently Asked Questions

What is the IUPAC name of [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine (CID 165480871) is [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine is CS(=O)(=O)c1cnn(-c2cccnc2CN)c1.
What is the InChIKey of [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine?
The InChIKey is JUESEYZZYWMKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S/c1-17(15,16)8-6-13-14(7-8)10-3-2-4-12-9(10)5-11/h2-4,6-7H,5,11H2,1H3.
What are the key properties of [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine?
[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine has a molecular weight of 252.30 g/mol, XLogP of 0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 165480871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).