N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine

C11H11F3N4 — CID 175103216

IUPACN-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine
SMILESCNc1cnn(Cc2ccnc(C(F)(F)F)c2)c1
InChIInChI=1S/C11H11F3N4/c1-15-9-5-17-18(7-9)6-8-2-3-16-10(4-8)11(12,13)14/h2-5,7,15H,6H2,1H3
InChIKeyFNRWIFIQPMVEKK-UHFFFAOYSA-N
MW256.23 g/mol
LogP2.39
Rot. Bonds3

About N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine

N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine (PubChem CID 175103216) has the molecular formula C11H11F3N4 and a molecular weight of 256.23 g/mol. Its IUPAC name is N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine.

Molecular Properties

Compound NameN-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine
PubChem CID175103216
Molecular FormulaC11H11F3N4
Molecular Weight256.23 g/mol
Exact Mass256.09
IUPAC NameN-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine
SMILESCNc1cnn(Cc2ccnc(C(F)(F)F)c2)c1
InChIInChI=1S/C11H11F3N4/c1-15-9-5-17-18(7-9)6-8-2-3-16-10(4-8)11(12,13)14/h2-5,7,15H,6H2,1H3
InChIKeyFNRWIFIQPMVEKK-UHFFFAOYSA-N
XLogP2.39
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.23
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-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

N-methyl-1-[[5-(trifluoromethyl)furan-2-yl]methyl]pyrazol-4-amine
CID 175094718
1-[(2,4-difluorophenyl)methyl]-N-methylpyrazol-4-amine
CID 175351355
N-methyl-1-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazol-4-amine;2,2,2-trifluoroacetic acid
CID 175100046
4-[(4-bromopyrazol-1-yl)methyl]-N-methylpyridin-2-amine
CID 62465451
N-methyl-1-[(6-prop-1-en-2-yl-3-pyridinyl)methyl]pyrazol-4-amine
CID 175103199
N-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]aniline
CID 151559909
4-(methylsulfanylmethyl)-2-(trifluoromethyl)pyridine
CID 141413257
1-[1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]pyrazol-4-yl]ethanol
CID 146194526
N-methyl-1-[(2,3,4-trifluorophenyl)methyl]pyrazol-4-amine
CID 175103195
1-[(2-chloro-4-fluorophenyl)methyl]-N-methylpyrazol-4-amine;hydrochloride
CID 175103248
2-methyl-N-[2-[2-(trifluoromethyl)-4-pyridinyl]ethyl]propan-2-amine
CID 155163777
2,2,2-trifluoro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]acetamide
CID 19346859

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine?
The IUPAC name of N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine (CID 175103216) is N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine.
What is the SMILES notation for N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine?
The canonical SMILES for N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine is CNc1cnn(Cc2ccnc(C(F)(F)F)c2)c1.
What is the InChIKey of N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine?
The InChIKey is FNRWIFIQPMVEKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4/c1-15-9-5-17-18(7-9)6-8-2-3-16-10(4-8)11(12,13)14/h2-5,7,15H,6H2,1H3.
What are the key properties of N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine?
N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine has a molecular weight of 256.23 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[[2-(trifluoromethyl)-4-pyridinyl]methyl]pyrazol-4-amine is sourced from PubChem (CID 175103216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).