5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide

C18H24N6O2 — CID 123376862

About 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide

5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide (PubChem CID 123376862) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide
• PubChem CID: 123376862
• Molecular Formula: C18H24N6O2
• Molecular Weight: 356.43 g/mol
• Exact Mass: 356.20
• IUPAC Name: 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide
• SMILES: Cc1cc(=O)cc(Nc2cc(NC3CCCCC3N)cnc2C(N)=O)[nH]1
• InChI: InChI=1S/C18H24N6O2/c1-10-6-12(25)8-16(22-10)24-15-7-11(9-21-17(15)18(20)26)23-14-5-3-2-4-13(14)19/h6-9,13-14,23H,2-5,19H2,1H3,(H2,20,26)(H2,22,24,25)
• InChIKey: PSTXAULROJVQNC-UHFFFAOYSA-N
• XLogP: 1.60
• TPSA: 138.92 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	356.43
LogP ≤ 5	1.60
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide?

The IUPAC name of 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide (CID 123376862) is 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide.

What is the SMILES notation for 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide?

The canonical SMILES for 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide is Cc1cc(=O)cc(Nc2cc(NC3CCCCC3N)cnc2C(N)=O)[nH]1.

What is the InChIKey of 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide?

The InChIKey is PSTXAULROJVQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c1-10-6-12(25)8-16(22-10)24-15-7-11(9-21-17(15)18(20)26)23-14-5-3-2-4-13(14)19/h6-9,13-14,23H,2-5,19H2,1H3,(H2,20,26)(H2,22,24,25).

What are the key properties of 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide?

5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 1.60, 5 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(2-aminocyclohexyl)amino]-3-[(6-methyl-4-oxo-1H-pyridin-2-yl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 123376862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).