2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide

C19H17N5O2 — CID 4216500

IUPAC2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
SMILESCc1cccnc1NC(=O)c1cccc(C(=O)Nc2ncccc2C)n1
InChIInChI=1S/C19H17N5O2/c1-12-6-4-10-20-16(12)23-18(25)14-8-3-9-15(22-14)19(26)24-17-13(2)7-5-11-21-17/h3-11H,1-2H3,(H,20,23,25)(H,21,24,26)
InChIKeyAMTVLDJNCULPJZ-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.99
Rot. Bonds4

About 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide

2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide (PubChem CID 4216500) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
PubChem CID4216500
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Name2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
SMILESCc1cccnc1NC(=O)c1cccc(C(=O)Nc2ncccc2C)n1
InChIInChI=1S/C19H17N5O2/c1-12-6-4-10-20-16(12)23-18(25)14-8-3-9-15(22-14)19(26)24-17-13(2)7-5-11-21-17/h3-11H,1-2H3,(H,20,23,25)(H,21,24,26)
InChIKeyAMTVLDJNCULPJZ-UHFFFAOYSA-N
XLogP2.99
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide (CID 4216500) is 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide is Cc1cccnc1NC(=O)c1cccc(C(=O)Nc2ncccc2C)n1.
What is the InChIKey of 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide?
The InChIKey is AMTVLDJNCULPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-12-6-4-10-20-16(12)23-18(25)14-8-3-9-15(22-14)19(26)24-17-13(2)7-5-11-21-17/h3-11H,1-2H3,(H,20,23,25)(H,21,24,26).
What are the key properties of 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide?
2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide has a molecular weight of 347.38 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 4216500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).