5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

C5H3Cl2N5 — CID 97290091

IUPAC5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nc2nc(Cl)cc(Cl)n2n1
InChIInChI=1S/C5H3Cl2N5/c6-2-1-3(7)12-5(9-2)10-4(8)11-12/h1H,(H2,8,11)
InChIKeyDZQKBFWGQQYJGN-UHFFFAOYSA-N
MW204.02 g/mol
LogP1.01
Rot. Bonds

About 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (PubChem CID 97290091) has the molecular formula C5H3Cl2N5 and a molecular weight of 204.02 g/mol. Its IUPAC name is 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
PubChem CID97290091
Molecular FormulaC5H3Cl2N5
Molecular Weight204.02 g/mol
Exact Mass202.98
IUPAC Name5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nc2nc(Cl)cc(Cl)n2n1
InChIInChI=1S/C5H3Cl2N5/c6-2-1-3(7)12-5(9-2)10-4(8)11-12/h1H,(H2,8,11)
InChIKeyDZQKBFWGQQYJGN-UHFFFAOYSA-N
XLogP1.01
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.02
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-methylquinoxaline
CID 89419976
2-amino-5-[(4-chlorophenyl)methyl]-6H-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-one
CID 136824658
2-amino-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 84719956
5,7-dichloroimidazo[1,2-a]pyrimidine
CID 23125107
5,7-dichloro-2-ethylpyrazolo[1,5-a]pyrimidine
CID 112694464
5,7-dichloroimidazo[1,2-a]pyrimidin-2-ol
CID 130066947
7-chloro-2-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 84679300
5,7-dichloro-2-piperidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 58530978
2-amino-7-methoxycarbonyl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 59461318
ethyl 5,7-dichloro-3-methylpyrazolo[1,5-a]pyrimidine-2-carboxylate
CID 162686171
4-(2-aminoethyl)-6-chloropyrimidin-2-amine
CID 83851850
2,5-diamino-[1,2,4]triazolo[1,5-a]pyrimidine-6,7-dicarbonitrile
CID 10352744

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (CID 97290091) is 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is Nc1nc2nc(Cl)cc(Cl)n2n1.
What is the InChIKey of 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is DZQKBFWGQQYJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2N5/c6-2-1-3(7)12-5(9-2)10-4(8)11-12/h1H,(H2,8,11).
What are the key properties of 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 204.02 g/mol, XLogP of 1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 97290091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).