4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine

C14H12FN5 — CID 114552624

IUPAC4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine
SMILESCn1nc(-c2ncccn2)c(-c2ccccc2F)c1N
InChIInChI=1S/C14H12FN5/c1-20-13(16)11(9-5-2-3-6-10(9)15)12(19-20)14-17-7-4-8-18-14/h2-8H,16H2,1H3
InChIKeyCZUJTSDVBUHCPA-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.27
Rot. Bonds2

About 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine

4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine (PubChem CID 114552624) has the molecular formula C14H12FN5 and a molecular weight of 269.28 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine
PubChem CID114552624
Molecular FormulaC14H12FN5
Molecular Weight269.28 g/mol
Exact Mass269.11
IUPAC Name4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine
SMILESCn1nc(-c2ncccn2)c(-c2ccccc2F)c1N
InChIInChI=1S/C14H12FN5/c1-20-13(16)11(9-5-2-3-6-10(9)15)12(19-20)14-17-7-4-8-18-14/h2-8H,16H2,1H3
InChIKeyCZUJTSDVBUHCPA-UHFFFAOYSA-N
XLogP2.27
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine 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

4-(2-fluorophenyl)-1-methyl-3-(1-methylpyrazol-3-yl)pyrazol-5-amine
CID 103118815
3-(2-chlorofuran-3-yl)-4-(2-fluorophenyl)-1-methylpyrazol-5-amine
CID 106687586
4-(3,5-difluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine
CID 114552622
3-(5-bromo-4-methylthiophen-2-yl)-4-(2-fluorophenyl)-1-methylpyrazol-5-amine
CID 79977683
4-(4-bromophenyl)-3-(2-fluorophenyl)-1-methylpyrazol-5-amine
CID 43336413
1,4-dimethyl-3-pyrimidin-2-ylpyrazol-5-amine
CID 114552607
4-(2-bromophenyl)-3-(3-fluoro-4-pyridinyl)-1-methylpyrazol-5-amine
CID 64949706
1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine
CID 80521659
4-(2-fluorophenyl)-1-methyl-3-(2-methylbutyl)pyrazol-5-amine
CID 114875030
4-(2-fluorophenyl)-3-(1-methylpyrazol-3-yl)-1,2-oxazol-5-amine
CID 103119567
3-(2,3-difluorophenyl)-1-methyl-4-pyridin-3-ylpyrazol-5-amine
CID 80522283
4-(3-chloro-2-fluorophenyl)-1-methyl-3-phenylpyrazol-5-amine
CID 82789468

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine?
The IUPAC name of 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine (CID 114552624) is 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine.
What is the SMILES notation for 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine?
The canonical SMILES for 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine is Cn1nc(-c2ncccn2)c(-c2ccccc2F)c1N.
What is the InChIKey of 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine?
The InChIKey is CZUJTSDVBUHCPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN5/c1-20-13(16)11(9-5-2-3-6-10(9)15)12(19-20)14-17-7-4-8-18-14/h2-8H,16H2,1H3.
What are the key properties of 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine?
4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine has a molecular weight of 269.28 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-1-methyl-3-pyrimidin-2-ylpyrazol-5-amine is sourced from PubChem (CID 114552624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).