2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine

C8H7Cl2N5 — CID 97057710

IUPAC2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine
SMILESCc1nn(-c2ncc(Cl)cc2Cl)nc1N
InChIInChI=1S/C8H7Cl2N5/c1-4-7(11)14-15(13-4)8-6(10)2-5(9)3-12-8/h2-3H,1H3,(H2,11,14)
InChIKeyQFBYDQXXBVRQSR-UHFFFAOYSA-N
MW244.09 g/mol
LogP1.86
Rot. Bonds1

About 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine

2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine (PubChem CID 97057710) has the molecular formula C8H7Cl2N5 and a molecular weight of 244.09 g/mol. Its IUPAC name is 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine.

Molecular Properties

Compound Name2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine
PubChem CID97057710
Molecular FormulaC8H7Cl2N5
Molecular Weight244.09 g/mol
Exact Mass243.01
IUPAC Name2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine
SMILESCc1nn(-c2ncc(Cl)cc2Cl)nc1N
InChIInChI=1S/C8H7Cl2N5/c1-4-7(11)14-15(13-4)8-6(10)2-5(9)3-12-8/h2-3H,1H3,(H2,11,14)
InChIKeyQFBYDQXXBVRQSR-UHFFFAOYSA-N
XLogP1.86
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.09
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dichloro-2-(1,2,4-triazol-4-yl)pyridine
CID 131020565
3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine
CID 63811503
1-(3,5-dichloro-2-pyridinyl)pyrazol-4-amine
CID 61175443
1-(3,5-dichloro-2-pyridinyl)-3,5-diethylpyrazol-4-amine
CID 82702386
1-(3-bromo-5-chloro-2-pyridinyl)-4-methylpyrazol-3-amine
CID 114836524
3,5-dichloro-2-(3,5-diethylpyrazol-1-yl)pyridine
CID 82698804
5-methyl-2-(2-methylphenyl)triazol-4-amine
CID 97058283
ethyl 1-(3,5-dichloro-2-pyridinyl)imidazole-4-carboxylate
CID 15069644
1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168698108
2-(3,5-dichloro-2-pyridinyl)propan-2-amine
CID 130160714
2-amino-1-[4-(3,5-dichloro-2-pyridinyl)piperazin-1-yl]propan-1-one
CID 119844372
methyl 2-(3,5-dichloro-2-pyridinyl)-5-methylpyrazole-3-carboxylate
CID 58158937

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine?
The IUPAC name of 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine (CID 97057710) is 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine.
What is the SMILES notation for 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine?
The canonical SMILES for 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine is Cc1nn(-c2ncc(Cl)cc2Cl)nc1N.
What is the InChIKey of 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine?
The InChIKey is QFBYDQXXBVRQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Cl2N5/c1-4-7(11)14-15(13-4)8-6(10)2-5(9)3-12-8/h2-3H,1H3,(H2,11,14).
What are the key properties of 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine?
2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine has a molecular weight of 244.09 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichloro-2-pyridinyl)-5-methyltriazol-4-amine is sourced from PubChem (CID 97057710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).