4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide

C19H18N6O2 — CID 91782580

About 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide

4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide (PubChem CID 91782580) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide.

Molecular Properties

• Compound Name: 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide
• PubChem CID: 91782580
• Molecular Formula: C19H18N6O2
• Molecular Weight: 362.39 g/mol
• Exact Mass: 362.15
• IUPAC Name: 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide
• SMILES: NC(=O)c1ccc(-c2nc3c([nH]2)CN(C(=O)c2ccc(N)nc2)CC3)cc1
• InChI: InChI=1S/C19H18N6O2/c20-16-6-5-13(9-22-16)19(27)25-8-7-14-15(10-25)24-18(23-14)12-3-1-11(2-4-12)17(21)26/h1-6,9H,7-8,10H2,(H2,20,22)(H2,21,26)(H,23,24)
• InChIKey: LBCLPUMTOGBFJX-UHFFFAOYSA-N
• XLogP: 1.35
• TPSA: 130.99 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	362.39
LogP ≤ 5	1.35
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide?

The IUPAC name of 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide (CID 91782580) is 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide.

What is the SMILES notation for 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide?

The canonical SMILES for 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide is NC(=O)c1ccc(-c2nc3c([nH]2)CN(C(=O)c2ccc(N)nc2)CC3)cc1.

What is the InChIKey of 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide?

The InChIKey is LBCLPUMTOGBFJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c20-16-6-5-13(9-22-16)19(27)25-8-7-14-15(10-25)24-18(23-14)12-3-1-11(2-4-12)17(21)26/h1-6,9H,7-8,10H2,(H2,20,22)(H2,21,26)(H,23,24).

What are the key properties of 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide?

4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide has a molecular weight of 362.39 g/mol, XLogP of 1.35, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[5-(6-aminopyridine-3-carbonyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide is sourced from PubChem (CID 91782580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).