8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine

C20H14ClN7 — CID 161497988

IUPAC8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine
SMILESCc1ccc(-c2nc(N)c3nccnc3c2-c2cc(Cl)c3ncnn3c2)cc1
InChIInChI=1S/C20H14ClN7/c1-11-2-4-12(5-3-11)16-15(17-18(19(22)27-16)24-7-6-23-17)13-8-14(21)20-25-10-26-28(20)9-13/h2-10H,1H3,(H2,22,27)
InChIKeyYGYWENVVUGREHC-UHFFFAOYSA-N
MW387.83 g/mol
LogP3.95
Rot. Bonds2

About 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine

8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine (PubChem CID 161497988) has the molecular formula C20H14ClN7 and a molecular weight of 387.83 g/mol. Its IUPAC name is 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine.

Molecular Properties

Compound Name8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine
PubChem CID161497988
Molecular FormulaC20H14ClN7
Molecular Weight387.83 g/mol
Exact Mass387.10
IUPAC Name8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine
SMILESCc1ccc(-c2nc(N)c3nccnc3c2-c2cc(Cl)c3ncnn3c2)cc1
InChIInChI=1S/C20H14ClN7/c1-11-2-4-12(5-3-11)16-15(17-18(19(22)27-16)24-7-6-23-17)13-8-14(21)20-25-10-26-28(20)9-13/h2-10H,1H3,(H2,22,27)
InChIKeyYGYWENVVUGREHC-UHFFFAOYSA-N
XLogP3.95
TPSA94.88 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.83
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine?
The IUPAC name of 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine (CID 161497988) is 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine.
What is the SMILES notation for 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine?
The canonical SMILES for 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine is Cc1ccc(-c2nc(N)c3nccnc3c2-c2cc(Cl)c3ncnn3c2)cc1.
What is the InChIKey of 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine?
The InChIKey is YGYWENVVUGREHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClN7/c1-11-2-4-12(5-3-11)16-15(17-18(19(22)27-16)24-7-6-23-17)13-8-14(21)20-25-10-26-28(20)9-13/h2-10H,1H3,(H2,22,27).
What are the key properties of 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine?
8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine has a molecular weight of 387.83 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-amine is sourced from PubChem (CID 161497988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).