8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide

C20H15N5O — CID 171092083

IUPAC8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide
SMILESCc1ccncc1-c1cc(C(=O)Nc2ccccn2)cc2nccnc12
InChIInChI=1S/C20H15N5O/c1-13-5-7-21-12-16(13)15-10-14(11-17-19(15)24-9-8-22-17)20(26)25-18-4-2-3-6-23-18/h2-12H,1H3,(H,23,25,26)
InChIKeyYSNIGMUWAFGXMA-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.65
Rot. Bonds3

About 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide

8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide (PubChem CID 171092083) has the molecular formula C20H15N5O and a molecular weight of 341.37 g/mol. Its IUPAC name is 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide.

Molecular Properties

Compound Name8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide
PubChem CID171092083
Molecular FormulaC20H15N5O
Molecular Weight341.37 g/mol
Exact Mass341.13
IUPAC Name8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide
SMILESCc1ccncc1-c1cc(C(=O)Nc2ccccn2)cc2nccnc12
InChIInChI=1S/C20H15N5O/c1-13-5-7-21-12-16(13)15-10-14(11-17-19(15)24-9-8-22-17)20(26)25-18-4-2-3-6-23-18/h2-12H,1H3,(H,23,25,26)
InChIKeyYSNIGMUWAFGXMA-UHFFFAOYSA-N
XLogP3.65
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide?
The IUPAC name of 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide (CID 171092083) is 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide.
What is the SMILES notation for 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide?
The canonical SMILES for 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide is Cc1ccncc1-c1cc(C(=O)Nc2ccccn2)cc2nccnc12.
What is the InChIKey of 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide?
The InChIKey is YSNIGMUWAFGXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O/c1-13-5-7-21-12-16(13)15-10-14(11-17-19(15)24-9-8-22-17)20(26)25-18-4-2-3-6-23-18/h2-12H,1H3,(H,23,25,26).
What are the key properties of 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide?
8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methyl-3-pyridinyl)-N-pyridin-2-ylquinoxaline-6-carboxamide is sourced from PubChem (CID 171092083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).