1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide

C9H10FN5O2S — CID 146141209

IUPAC1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide
SMILESO=S(=O)(CC1(F)CC1)Nc1ccnc2ncnn12
InChIInChI=1S/C9H10FN5O2S/c10-9(2-3-9)5-18(16,17)14-7-1-4-11-8-12-6-13-15(7)8/h1,4,6,14H,2-3,5H2
InChIKeyBZUILTQTWKXJQG-UHFFFAOYSA-N
MW271.28 g/mol
LogP0.37
Rot. Bonds4

About 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide

1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide (PubChem CID 146141209) has the molecular formula C9H10FN5O2S and a molecular weight of 271.28 g/mol. Its IUPAC name is 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide.

Molecular Properties

Compound Name1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide
PubChem CID146141209
Molecular FormulaC9H10FN5O2S
Molecular Weight271.28 g/mol
Exact Mass271.05
IUPAC Name1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide
SMILESO=S(=O)(CC1(F)CC1)Nc1ccnc2ncnn12
InChIInChI=1S/C9H10FN5O2S/c10-9(2-3-9)5-18(16,17)14-7-1-4-11-8-12-6-13-15(7)8/h1,4,6,14H,2-3,5H2
InChIKeyBZUILTQTWKXJQG-UHFFFAOYSA-N
XLogP0.37
TPSA89.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

US9932325, Example 154
CID 132244723
3,3,3-trifluoro-N-(pyrazolo[1,5-a]pyrimidin-6-yl)propane-1-sulfonamide
CID 91629192
N-(2-((6-(1H-pyrazol-1-yl)pyrimidin-4-yl)amino)ethyl)butane-1-sulfonamide
CID 30868172
N-(fluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
CID 21571291
5-Fluoro-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide
CID 140993684
2-(1-Cyclopropylsulfonylpyrazol-4-yl)-5-fluoropyrimidin-4-amine
CID 167425768
7-Amino-6-(methylsulfonyl)pyrazolo[1,5-a]-pyrimidine
CID 129768517
4,4,4-trifluoro-N-(1-pyrimidin-2-ylpyrazol-4-yl)butane-1-sulfonamide
CID 100714855
2,2,2-trifluoro-N-(2-pyrimidin-2-yl-1,2,4-triazol-3-yl)ethanesulfonamide
CID 146150736
{Pyrazolo[1,5-a]pyrimidin-6-yl}methanesulfonyl fluoride
CID 165967233
Pyrazolo[1,5-a][1,3,5]triazine-2-sulfonamide
CID 19870951
[1,2,4]Triazolo[1,5-c]pyrimidine-2-sulfonamide
CID 23303943

Frequently Asked Questions

What is the IUPAC name of 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide?
The IUPAC name of 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide (CID 146141209) is 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide.
What is the SMILES notation for 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide?
The canonical SMILES for 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide is O=S(=O)(CC1(F)CC1)Nc1ccnc2ncnn12.
What is the InChIKey of 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide?
The InChIKey is BZUILTQTWKXJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN5O2S/c10-9(2-3-9)5-18(16,17)14-7-1-4-11-8-12-6-13-15(7)8/h1,4,6,14H,2-3,5H2.
What are the key properties of 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide?
1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide has a molecular weight of 271.28 g/mol, XLogP of 0.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluorocyclopropyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanesulfonamide is sourced from PubChem (CID 146141209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).