6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine

C10H14F3N3 — CID 58157179

IUPAC6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
SMILESCCN1CCc2c(C(F)(F)F)nn(C)c2C1
InChIInChI=1S/C10H14F3N3/c1-3-16-5-4-7-8(6-16)15(2)14-9(7)10(11,12)13/h3-6H2,1-2H3
InChIKeyCUYPMWKHJYZDMH-UHFFFAOYSA-N
MW233.24 g/mol
LogP1.82
Rot. Bonds1

About 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine

6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine (PubChem CID 58157179) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
PubChem CID58157179
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC Name6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
SMILESCCN1CCc2c(C(F)(F)F)nn(C)c2C1
InChIInChI=1S/C10H14F3N3/c1-3-16-5-4-7-8(6-16)15(2)14-9(7)10(11,12)13/h3-6H2,1-2H3
InChIKeyCUYPMWKHJYZDMH-UHFFFAOYSA-N
XLogP1.82
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethyl-2H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine
CID 82417238
6-(cyclopropylmethyl)-1-methyl-3-(pyrrolidin-1-ylmethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
CID 97404995
1-[6-(cyclopropylmethyl)-1-propan-2-yl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylmethanamine
CID 97405042
6-(cyclopropylmethyl)-1-propan-2-yl-3-(pyrrolidin-1-ylmethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
CID 97405048
1,3-dimethyl-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine dihydrochloride
CID 137951586
1-[(2,5-Dimethylpyrazol-3-yl)methyl]-4-(fluoromethyl)piperidine
CID 126790761
1-(Difluoromethyl)-3,4,5-trimethylpyrazole
CID 21136569
1,3,5-Trimethyl-4-(trifluoromethyl)-1H-pyrazole
CID 22980766
1,3,4-Trimethyl-5-(trifluoromethyl)pyrazole
CID 23392033
1,4,5-Trimethyl-3-(trifluoromethyl)pyrazole
CID 23392035
1-Methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1h-pyrazolo[3,4-c]pyridine
CID 45096965
1-Methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1h-pyrazolo[4,3-c]pyridine
CID 45096966

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The IUPAC name of 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine (CID 58157179) is 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine.
What is the SMILES notation for 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The canonical SMILES for 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine is CCN1CCc2c(C(F)(F)F)nn(C)c2C1.
What is the InChIKey of 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The InChIKey is CUYPMWKHJYZDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c1-3-16-5-4-7-8(6-16)15(2)14-9(7)10(11,12)13/h3-6H2,1-2H3.
What are the key properties of 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine has a molecular weight of 233.24 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-methyl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine is sourced from PubChem (CID 58157179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).