7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

C9H7N5S — CID 11458611

IUPAC7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nc2nccc(-c3ccsc3)n2n1
InChIInChI=1S/C9H7N5S/c10-8-12-9-11-3-1-7(14(9)13-8)6-2-4-15-5-6/h1-5H,(H2,10,13)
InChIKeyHGWYWRRTCJRKCW-UHFFFAOYSA-N
MW217.26 g/mol
LogP1.43
Rot. Bonds1

About 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (PubChem CID 11458611) has the molecular formula C9H7N5S and a molecular weight of 217.26 g/mol. Its IUPAC name is 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
PubChem CID11458611
Molecular FormulaC9H7N5S
Molecular Weight217.26 g/mol
Exact Mass217.04
IUPAC Name7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nc2nccc(-c3ccsc3)n2n1
InChIInChI=1S/C9H7N5S/c10-8-12-9-11-3-1-7(14(9)13-8)6-2-4-15-5-6/h1-5H,(H2,10,13)
InChIKeyHGWYWRRTCJRKCW-UHFFFAOYSA-N
XLogP1.43
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-thiophen-2-yl-7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 66498261
2-(methoxymethyl)-7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 47001302
7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 1478926
methyl 2-(7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetate
CID 103200965
7-(3-phenylmethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 11209321
2-methyl-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 30465384
2-(phenoxymethyl)-7-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 110205345
4-thiophen-3-ylpyridine-2,3-diamine
CID 118914538
7-(4-methoxyphenyl)-2-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 66497840
2-thiophen-2-yl-7-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 71708725
7-(4-methoxyphenyl)-2-methyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 66491531
(2-thiophen-3-ylpyrimidin-4-yl)methanamine
CID 62749673

Frequently Asked Questions

What is the IUPAC name of 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (CID 11458611) is 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is Nc1nc2nccc(-c3ccsc3)n2n1.
What is the InChIKey of 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is HGWYWRRTCJRKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5S/c10-8-12-9-11-3-1-7(14(9)13-8)6-2-4-15-5-6/h1-5H,(H2,10,13).
What are the key properties of 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 217.26 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 11458611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).