6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine

C14H14ClN5 — CID 82555800

IUPAC6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
SMILESCc1cc(NCc2ccccc2Cl)cn2nc(N)nc12
InChIInChI=1S/C14H14ClN5/c1-9-6-11(8-20-13(9)18-14(16)19-20)17-7-10-4-2-3-5-12(10)15/h2-6,8,17H,7H2,1H3,(H2,16,19)
InChIKeyFPJSKFXYLOMYTO-UHFFFAOYSA-N
MW287.75 g/mol
LogP2.89
Rot. Bonds3

About 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine

6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine (PubChem CID 82555800) has the molecular formula C14H14ClN5 and a molecular weight of 287.75 g/mol. Its IUPAC name is 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
PubChem CID82555800
Molecular FormulaC14H14ClN5
Molecular Weight287.75 g/mol
Exact Mass287.09
IUPAC Name6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
SMILESCc1cc(NCc2ccccc2Cl)cn2nc(N)nc12
InChIInChI=1S/C14H14ClN5/c1-9-6-11(8-20-13(9)18-14(16)19-20)17-7-10-4-2-3-5-12(10)15/h2-6,8,17H,7H2,1H3,(H2,16,19)
InChIKeyFPJSKFXYLOMYTO-UHFFFAOYSA-N
XLogP2.89
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine with MolForge

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Related Compounds

2-N-[(2-chlorophenyl)methyl]-6-methylpyrimidine-2,4-diamine
CID 71945279
N-[(2-chlorophenyl)methyl]-3-ethyl-4-methylaniline
CID 114250155
6-N-[(2-chlorophenyl)methyl]-4-N-(2-methylphenyl)pyrimidine-4,5,6-triamine
CID 19147870
5-N-[(2-chlorophenyl)methyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 66027142
4-[(2-chlorophenyl)methylamino]phenol
CID 18778398
2-chloro-N-[(2-chlorophenyl)methyl]-3-methylaniline
CID 114251746
N-[(2-chlorophenyl)methyl]-3-methoxyaniline
CID 23795463
3-N-[(2-chlorophenyl)methyl]-5-fluorobenzene-1,3-diamine
CID 60875169
5-N-[(2-chlorophenyl)methyl]-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029529
6-N-[(2-chlorophenyl)methyl]-4-N,4-N-diethyl-2-methylpyrimidine-4,6-diamine
CID 112872603
N-[(2-chlorophenyl)methyl]-3-ethyl-1-methylpyrazol-4-amine
CID 103909171
2-[(2-chlorophenyl)methylamino]-4-methyl-1H-pyrimidin-6-one
CID 135764107

Frequently Asked Questions

What is the IUPAC name of 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The IUPAC name of 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine (CID 82555800) is 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine.
What is the SMILES notation for 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The canonical SMILES for 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine is Cc1cc(NCc2ccccc2Cl)cn2nc(N)nc12.
What is the InChIKey of 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The InChIKey is FPJSKFXYLOMYTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN5/c1-9-6-11(8-20-13(9)18-14(16)19-20)17-7-10-4-2-3-5-12(10)15/h2-6,8,17H,7H2,1H3,(H2,16,19).
What are the key properties of 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine has a molecular weight of 287.75 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine is sourced from PubChem (CID 82555800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).