5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine

C10H16N4 — CID 10375325

IUPAC5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCCn1cc(C2=CCCN(C)C2)nn1
InChIInChI=1S/C10H16N4/c1-3-14-8-10(11-12-14)9-5-4-6-13(2)7-9/h5,8H,3-4,6-7H2,1-2H3
InChIKeyBFFNUXCFIAZLRG-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.02
Rot. Bonds2

About 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine

5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine (PubChem CID 10375325) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine
PubChem CID10375325
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCCn1cc(C2=CCCN(C)C2)nn1
InChIInChI=1S/C10H16N4/c1-3-14-8-10(11-12-14)9-5-4-6-13(2)7-9/h5,8H,3-4,6-7H2,1-2H3
InChIKeyBFFNUXCFIAZLRG-UHFFFAOYSA-N
XLogP1.02
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methyl-4-(1-methyl-1,2,5,6-tetrahydro-3-pyridyl)-1,2,3-triazole
CID 10442260
5-(2-Ethyl-2H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine
CID 10012808
5-(3-Ethyl-3H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine
CID 10058412
1-Methyl-5-(2-prop-2-ynyl-2H-[1,2,3]triazol-4-yl)-1,2,3,6-tetrahydro-pyridine
CID 10104311
1-Methyl-5-(2-vinyl-2H-[1,2,3]triazol-4-yl)-1,2,3,6-tetrahydro-pyridine
CID 10241624
5-(2-Butyl-2H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine
CID 10262914
5-(2-Allyl-2H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine
CID 10465525
1-Methyl-5-(2-propyl-2H-1,2,3-triazol-4-yl)-1,2,3,6-tetrahydropyridine
CID 11820311
4-[(3E,5E)-6-fluoroocta-1,3,5,7-tetraen-4-yl]-1-methyltriazole
CID 129203743
1-tert-butyl-4-[(3E,5E)-6-fluoroocta-1,3,5,7-tetraen-4-yl]triazole
CID 146643716
1-Tert-butyl-4-(5-fluorocyclohexa-1,5-dien-1-yl)triazole
CID 155426530
4-[(2E,4E)-5-fluorohepta-2,4,6-trien-3-yl]-1-methyltriazole
CID 166900186

Frequently Asked Questions

What is the IUPAC name of 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine (CID 10375325) is 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine is CCn1cc(C2=CCCN(C)C2)nn1.
What is the InChIKey of 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The InChIKey is BFFNUXCFIAZLRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-3-14-8-10(11-12-14)9-5-4-6-13(2)7-9/h5,8H,3-4,6-7H2,1-2H3.
What are the key properties of 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine?
5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine has a molecular weight of 192.27 g/mol, XLogP of 1.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethyltriazol-4-yl)-1-methyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 10375325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).