4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine

C13H15F2N3 — CID 140655069

IUPAC4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine
SMILESCCNc1c(-c2c(F)cccc2F)c(C)nn1C
InChIInChI=1S/C13H15F2N3/c1-4-16-13-11(8(2)17-18(13)3)12-9(14)6-5-7-10(12)15/h5-7,16H,4H2,1-3H3
InChIKeyFEAPAMRCBJVJGF-UHFFFAOYSA-N
MW251.28 g/mol
LogP3.11
Rot. Bonds3

About 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine

4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine (PubChem CID 140655069) has the molecular formula C13H15F2N3 and a molecular weight of 251.28 g/mol. Its IUPAC name is 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine
PubChem CID140655069
Molecular FormulaC13H15F2N3
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC Name4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine
SMILESCCNc1c(-c2c(F)cccc2F)c(C)nn1C
InChIInChI=1S/C13H15F2N3/c1-4-16-13-11(8(2)17-18(13)3)12-9(14)6-5-7-10(12)15/h5-7,16H,4H2,1-3H3
InChIKeyFEAPAMRCBJVJGF-UHFFFAOYSA-N
XLogP3.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-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-(2,6-difluorophenyl)-5-ethoxy-1,3-dimethylpyrazole
CID 140655072
[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methanol
CID 62194679
5-(ethylamino)-1,3-dimethylpyrazole-4-carbonitrile
CID 63757322
N-ethyl-2,6-difluoroaniline
CID 23270171
5-N-[2-(2-fluorophenyl)ethyl]-1,3-dimethylpyrazole-4,5-diamine
CID 43554049
1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one
CID 62208668
N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine
CID 62202694
3-chloro-2-N-[4-(2,6-difluoro-4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]benzene-1,2-diamine
CID 137458325
2-(2,6-difluorophenyl)-1,3-difluorobenzene
CID 13068684
N-[(2-chloro-6-fluorophenyl)methyl]-1,3,5-trimethylpyrazol-4-amine
CID 28664744
4-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methylsulfanyl]phenol
CID 55044477
1-[4-(2-chloro-6-fluorophenyl)-1,3-dimethylpyrazol-5-yl]-2-methylbutan-1-amine
CID 140655063

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine?
The IUPAC name of 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine (CID 140655069) is 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine.
What is the SMILES notation for 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine?
The canonical SMILES for 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine is CCNc1c(-c2c(F)cccc2F)c(C)nn1C.
What is the InChIKey of 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine?
The InChIKey is FEAPAMRCBJVJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F2N3/c1-4-16-13-11(8(2)17-18(13)3)12-9(14)6-5-7-10(12)15/h5-7,16H,4H2,1-3H3.
What are the key properties of 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine?
4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine has a molecular weight of 251.28 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine is sourced from PubChem (CID 140655069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).