7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine

C15H10N4 — CID 900903

IUPAC7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESc1ccc2cc(-c3ccnc4ncnn34)ccc2c1
InChIInChI=1S/C15H10N4/c1-2-4-12-9-13(6-5-11(12)3-1)14-7-8-16-15-17-10-18-19(14)15/h1-10H
InChIKeyHYMZYJKQNNNIIT-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.94
Rot. Bonds1

About 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine

7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 900903) has the molecular formula C15H10N4 and a molecular weight of 246.27 g/mol. Its IUPAC name is 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID900903
Molecular FormulaC15H10N4
Molecular Weight246.27 g/mol
Exact Mass246.09
IUPAC Name7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESc1ccc2cc(-c3ccnc4ncnn34)ccc2c1
InChIInChI=1S/C15H10N4/c1-2-4-12-9-13(6-5-11(12)3-1)14-7-8-16-15-17-10-18-19(14)15/h1-10H
InChIKeyHYMZYJKQNNNIIT-UHFFFAOYSA-N
XLogP2.94
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5,7-dichloro-6-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 22440103
3-(4-bromophenyl)-7-naphthalen-2-ylpyrazolo[1,5-a]pyrimidine
CID 66498426
7-[3-[(2,4-dichlorophenyl)methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 1477544
2-phenoxy-N-[[4-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)phenyl]methyl]acetamide
CID 92575366
3-fluoro-4-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzonitrile
CID 122540763
3,3-dimethyl-1-[3-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)phenyl]azetidin-2-one
CID 3714506
6-pyrazolo[1,5-a]pyrimidin-7-ylnaphthalen-2-ol
CID 166336559
[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 2763474
iridium;5-naphthalen-2-yl-1-phenylpyrazole
CID 153435553
4-[5-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyridine-2-carbonitrile
CID 178156438
2-naphthalen-2-yl-1-phenylpyrrolo[2,3-b]pyridine
CID 139192071
7-(1,3-dimethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 4773198

Frequently Asked Questions

What is the IUPAC name of 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine (CID 900903) is 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine is c1ccc2cc(-c3ccnc4ncnn34)ccc2c1.
What is the InChIKey of 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is HYMZYJKQNNNIIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4/c1-2-4-12-9-13(6-5-11(12)3-1)14-7-8-16-15-17-10-18-19(14)15/h1-10H.
What are the key properties of 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 246.27 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-naphthalen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 900903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).