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

C10H16N4 — CID 10867177

IUPAC5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCc1nc(C2=CCCN(C)C2)nn1C
InChIInChI=1S/C10H16N4/c1-8-11-10(12-14(8)3)9-5-4-6-13(2)7-9/h5H,4,6-7H2,1-3H3
InChIKeyFTXSOKQSMGYGRE-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.84
Rot. Bonds1

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

5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine (PubChem CID 10867177) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine
PubChem CID10867177
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCc1nc(C2=CCCN(C)C2)nn1C
InChIInChI=1S/C10H16N4/c1-8-11-10(12-14(8)3)9-5-4-6-13(2)7-9/h5H,4,6-7H2,1-3H3
InChIKeyFTXSOKQSMGYGRE-UHFFFAOYSA-N
XLogP0.84
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine (CID 10867177) is 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine is Cc1nc(C2=CCCN(C)C2)nn1C.
What is the InChIKey of 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The InChIKey is FTXSOKQSMGYGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-8-11-10(12-14(8)3)9-5-4-6-13(2)7-9/h5H,4,6-7H2,1-3H3.
What are the key properties of 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine?
5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine has a molecular weight of 192.27 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-methyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 10867177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).