3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol

C19H19N5O2 — CID 138607513

About 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol

3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol (PubChem CID 138607513) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol.

Molecular Properties

• Compound Name: 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
• PubChem CID: 138607513
• Molecular Formula: C19H19N5O2
• Molecular Weight: 349.39 g/mol
• Exact Mass: 349.15
• IUPAC Name: 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
• SMILES: COc1cccc(-c2ccc3c(c2)nc(N)c2[nH]c(CCCO)nc23)n1
• InChI: InChI=1S/C19H19N5O2/c1-26-16-6-2-4-13(21-16)11-7-8-12-14(10-11)22-19(20)18-17(12)23-15(24-18)5-3-9-25/h2,4,6-8,10,25H,3,5,9H2,1H3,(H2,20,22)(H,23,24)
• InChIKey: HPFZVHGROCEGLT-UHFFFAOYSA-N
• XLogP: 2.69
• TPSA: 109.94 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	349.39
LogP ≤ 5	2.69
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol?

The IUPAC name of 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol (CID 138607513) is 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol.

What is the SMILES notation for 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol?

The canonical SMILES for 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol is COc1cccc(-c2ccc3c(c2)nc(N)c2[nH]c(CCCO)nc23)n1.

What is the InChIKey of 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol?

The InChIKey is HPFZVHGROCEGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-26-16-6-2-4-13(21-16)11-7-8-12-14(10-11)22-19(20)18-17(12)23-15(24-18)5-3-9-25/h2,4,6-8,10,25H,3,5,9H2,1H3,(H2,20,22)(H,23,24).

What are the key properties of 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol?

3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol has a molecular weight of 349.39 g/mol, XLogP of 2.69, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol is sourced from PubChem (CID 138607513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).