2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine

C13H10F3N5 — CID 122654637

IUPAC2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine
SMILESNc1ccc(C(F)(F)F)nc1Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C13H10F3N5/c14-13(15,16)11-4-2-9(17)12(20-11)19-8-1-3-10-7(5-8)6-18-21-10/h1-6H,17H2,(H,18,21)(H,19,20)
InChIKeyZFGPIQOBHAZMKK-UHFFFAOYSA-N
MW293.25 g/mol
LogP3.30
Rot. Bonds2

About 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine

2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine (PubChem CID 122654637) has the molecular formula C13H10F3N5 and a molecular weight of 293.25 g/mol. Its IUPAC name is 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine
PubChem CID122654637
Molecular FormulaC13H10F3N5
Molecular Weight293.25 g/mol
Exact Mass293.09
IUPAC Name2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine
SMILESNc1ccc(C(F)(F)F)nc1Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C13H10F3N5/c14-13(15,16)11-4-2-9(17)12(20-11)19-8-1-3-10-7(5-8)6-18-21-10/h1-6H,17H2,(H,18,21)(H,19,20)
InChIKeyZFGPIQOBHAZMKK-UHFFFAOYSA-N
XLogP3.30
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.25
LogP ≤ 53.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-phenyl-6-(trifluoromethyl)pyridine-2,3-diamine
CID 70979281
N-(4-fluorophenyl)-1H-indazol-5-amine
CID 91229030
4-N-(1H-indazol-5-yl)-2-N-[3-(trifluoromethyl)phenyl]quinazoline-2,4-diamine
CID 68702577
N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine
CID 102049744
N-(2-chloro-5-fluoropyrimidin-4-yl)-1H-indazol-5-amine
CID 22060782
N-(3-methyl-5-nitro-2-pyridinyl)-1H-indazol-5-amine
CID 133425970
N-(2,6-difluoro-4-nitrophenyl)-1H-indazol-5-amine
CID 166232105
N-[2-(3,4-difluorophenyl)-5-fluoropyrimidin-4-yl]-1H-indazol-5-amine
CID 122589652
N-(6-ethyl-5-fluoropyrimidin-4-yl)-1H-indazol-5-amine
CID 133416322
4-N-(1H-indazol-5-yl)-2-N-[[2-(trifluoromethyl)phenyl]methyl]thieno[3,2-d]pyrimidine-2,4-diamine
CID 10216807
N-(1H-indazol-5-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 78324014
5-(4-amino-2-pyridinyl)-N-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-amine;ethane
CID 145146553

Frequently Asked Questions

What is the IUPAC name of 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine?
The IUPAC name of 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine (CID 122654637) is 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine.
What is the SMILES notation for 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine?
The canonical SMILES for 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine is Nc1ccc(C(F)(F)F)nc1Nc1ccc2[nH]ncc2c1.
What is the InChIKey of 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine?
The InChIKey is ZFGPIQOBHAZMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N5/c14-13(15,16)11-4-2-9(17)12(20-11)19-8-1-3-10-7(5-8)6-18-21-10/h1-6H,17H2,(H,18,21)(H,19,20).
What are the key properties of 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine?
2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine has a molecular weight of 293.25 g/mol, XLogP of 3.30, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2,3-diamine is sourced from PubChem (CID 122654637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).