1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine

C11H14F3N5 — CID 19626303

IUPAC1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine
SMILESCc1cc(NCc2cc(C(F)(F)F)n(C)n2)nn1C
InChIInChI=1S/C11H14F3N5/c1-7-4-10(17-18(7)2)15-6-8-5-9(11(12,13)14)19(3)16-8/h4-5H,6H2,1-3H3,(H,15,17)
InChIKeyDOBAPXLTSRUEMV-UHFFFAOYSA-N
MW273.26 g/mol
LogP2.09
Rot. Bonds3

About 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine

1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine (PubChem CID 19626303) has the molecular formula C11H14F3N5 and a molecular weight of 273.26 g/mol. Its IUPAC name is 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine
PubChem CID19626303
Molecular FormulaC11H14F3N5
Molecular Weight273.26 g/mol
Exact Mass273.12
IUPAC Name1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine
SMILESCc1cc(NCc2cc(C(F)(F)F)n(C)n2)nn1C
InChIInChI=1S/C11H14F3N5/c1-7-4-10(17-18(7)2)15-6-8-5-9(11(12,13)14)19(3)16-8/h4-5H,6H2,1-3H3,(H,15,17)
InChIKeyDOBAPXLTSRUEMV-UHFFFAOYSA-N
XLogP2.09
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine?
The IUPAC name of 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine (CID 19626303) is 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine?
The canonical SMILES for 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine is Cc1cc(NCc2cc(C(F)(F)F)n(C)n2)nn1C.
What is the InChIKey of 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine?
The InChIKey is DOBAPXLTSRUEMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N5/c1-7-4-10(17-18(7)2)15-6-8-5-9(11(12,13)14)19(3)16-8/h4-5H,6H2,1-3H3,(H,15,17).
What are the key properties of 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine?
1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine has a molecular weight of 273.26 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]pyrazol-3-amine is sourced from PubChem (CID 19626303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).