4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine

C18H20N6O2 — CID 72873967

About 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine

4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine (PubChem CID 72873967) has the molecular formula C18H20N6O2 and a molecular weight of 352.40 g/mol. Its IUPAC name is 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine.

Molecular Properties

• Compound Name: 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine
• PubChem CID: 72873967
• Molecular Formula: C18H20N6O2
• Molecular Weight: 352.40 g/mol
• Exact Mass: 352.16
• IUPAC Name: 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine
• SMILES: COc1ccc(-c2nc3c([nH]2)CN(c2cc(OC)nc(N)n2)CC3)cc1
• InChI: InChI=1S/C18H20N6O2/c1-25-12-5-3-11(4-6-12)17-20-13-7-8-24(10-14(13)21-17)15-9-16(26-2)23-18(19)22-15/h3-6,9H,7-8,10H2,1-2H3,(H,20,21)(H2,19,22,23)
• InChIKey: BEEDGZUGGOCPGB-UHFFFAOYSA-N
• XLogP: 2.03
• TPSA: 102.18 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	352.40
LogP ≤ 5	2.03
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine?

The IUPAC name of 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine (CID 72873967) is 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine.

What is the SMILES notation for 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine?

The canonical SMILES for 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine is COc1ccc(-c2nc3c([nH]2)CN(c2cc(OC)nc(N)n2)CC3)cc1.

What is the InChIKey of 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine?

The InChIKey is BEEDGZUGGOCPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2/c1-25-12-5-3-11(4-6-12)17-20-13-7-8-24(10-14(13)21-17)15-9-16(26-2)23-18(19)22-15/h3-6,9H,7-8,10H2,1-2H3,(H,20,21)(H2,19,22,23).

What are the key properties of 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine?

4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine has a molecular weight of 352.40 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-methoxy-6-[2-(4-methoxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]pyrimidin-2-amine is sourced from PubChem (CID 72873967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).