4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine

C8H10FN5 — CID 165492554

IUPAC4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine
SMILESCn1ccnc1-c1nn(C)c(N)c1F
InChIInChI=1S/C8H10FN5/c1-13-4-3-11-8(13)6-5(9)7(10)14(2)12-6/h3-4H,10H2,1-2H3
InChIKeyXSGOAVXTWGADFV-UHFFFAOYSA-N
MW195.20 g/mol
LogP0.54
Rot. Bonds1

About 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine

4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine (PubChem CID 165492554) has the molecular formula C8H10FN5 and a molecular weight of 195.20 g/mol. Its IUPAC name is 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine.

Molecular Properties

Compound Name4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine
PubChem CID165492554
Molecular FormulaC8H10FN5
Molecular Weight195.20 g/mol
Exact Mass195.09
IUPAC Name4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine
SMILESCn1ccnc1-c1nn(C)c(N)c1F
InChIInChI=1S/C8H10FN5/c1-13-4-3-11-8(13)6-5(9)7(10)14(2)12-6/h3-4H,10H2,1-2H3
InChIKeyXSGOAVXTWGADFV-UHFFFAOYSA-N
XLogP0.54
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine?
The IUPAC name of 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine (CID 165492554) is 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine.
What is the SMILES notation for 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine?
The canonical SMILES for 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine is Cn1ccnc1-c1nn(C)c(N)c1F.
What is the InChIKey of 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine?
The InChIKey is XSGOAVXTWGADFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN5/c1-13-4-3-11-8(13)6-5(9)7(10)14(2)12-6/h3-4H,10H2,1-2H3.
What are the key properties of 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine?
4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine has a molecular weight of 195.20 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-amine is sourced from PubChem (CID 165492554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).