5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine

C13H16N4 — CID 920235

IUPAC5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine
SMILESCCN1CCc2c(nnn2-c2ccccc2)C1
InChIInChI=1S/C13H16N4/c1-2-16-9-8-13-12(10-16)14-15-17(13)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3
InChIKeyAWGPWKGQRYIHJK-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.65
Rot. Bonds2

About 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine

5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine (PubChem CID 920235) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine.

Molecular Properties

Compound Name5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine
PubChem CID920235
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine
SMILESCCN1CCc2c(nnn2-c2ccccc2)C1
InChIInChI=1S/C13H16N4/c1-2-16-9-8-13-12(10-16)14-15-17(13)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3
InChIKeyAWGPWKGQRYIHJK-UHFFFAOYSA-N
XLogP1.65
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine?
The IUPAC name of 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine (CID 920235) is 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine.
What is the SMILES notation for 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine?
The canonical SMILES for 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine is CCN1CCc2c(nnn2-c2ccccc2)C1.
What is the InChIKey of 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine?
The InChIKey is AWGPWKGQRYIHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-2-16-9-8-13-12(10-16)14-15-17(13)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3.
What are the key properties of 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine?
5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine has a molecular weight of 228.30 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-phenyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine is sourced from PubChem (CID 920235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).