6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline

C34H26N6 — CID 144941020

IUPAC6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline
SMILESCc1cccc2c(-c3ccc4nccnc4n3)c[nH]c12.Cc1cccc2c(-c3cnc4ccccc4c3)c[nH]c12
InChIInChI=1S/C18H14N2.C16H12N4/c1-12-5-4-7-15-16(11-20-18(12)15)14-9-13-6-2-3-8-17(13)19-10-14;1-10-3-2-4-11-12(9-19-15(10)11)13-5-6-14-16(20-13)18-8-7-17-14/h2-11,20H,1H3;2-9,19H,1H3
InChIKeyVKSKCDPQNDUGMP-UHFFFAOYSA-N
MW518.62 g/mol
LogP8.17
Rot. Bonds2

About 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline

6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline (PubChem CID 144941020) has the molecular formula C34H26N6 and a molecular weight of 518.62 g/mol. Its IUPAC name is 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline.

Molecular Properties

Compound Name6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline
PubChem CID144941020
Molecular FormulaC34H26N6
Molecular Weight518.62 g/mol
Exact Mass518.22
IUPAC Name6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline
SMILESCc1cccc2c(-c3ccc4nccnc4n3)c[nH]c12.Cc1cccc2c(-c3cnc4ccccc4c3)c[nH]c12
InChIInChI=1S/C18H14N2.C16H12N4/c1-12-5-4-7-15-16(11-20-18(12)15)14-9-13-6-2-3-8-17(13)19-10-14;1-10-3-2-4-11-12(9-19-15(10)11)13-5-6-14-16(20-13)18-8-7-17-14/h2-11,20H,1H3;2-9,19H,1H3
InChIKeyVKSKCDPQNDUGMP-UHFFFAOYSA-N
XLogP8.17
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms40
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.62
LogP ≤ 58.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline?
The IUPAC name of 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline (CID 144941020) is 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline.
What is the SMILES notation for 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline?
The canonical SMILES for 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline is Cc1cccc2c(-c3ccc4nccnc4n3)c[nH]c12.Cc1cccc2c(-c3cnc4ccccc4c3)c[nH]c12.
What is the InChIKey of 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline?
The InChIKey is VKSKCDPQNDUGMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2.C16H12N4/c1-12-5-4-7-15-16(11-20-18(12)15)14-9-13-6-2-3-8-17(13)19-10-14;1-10-3-2-4-11-12(9-19-15(10)11)13-5-6-14-16(20-13)18-8-7-17-14/h2-11,20H,1H3;2-9,19H,1H3.
What are the key properties of 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline?
6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline has a molecular weight of 518.62 g/mol, XLogP of 8.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-methyl-1H-indol-3-yl)pyrido[2,3-b]pyrazine;3-(7-methyl-1H-indol-3-yl)quinoline is sourced from PubChem (CID 144941020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).