5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline

C17H14N4O — CID 18783998

IUPAC5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline
SMILESCOc1ccc(-c2nc3ccncc3[nH]2)c2ccc(C)nc12
InChIInChI=1S/C17H14N4O/c1-10-3-4-11-12(5-6-15(22-2)16(11)19-10)17-20-13-7-8-18-9-14(13)21-17/h3-9H,1-2H3,(H,20,21)
InChIKeyOOAGZITVPQUHTC-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.49
Rot. Bonds2

About 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline

5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline (PubChem CID 18783998) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline.

Molecular Properties

Compound Name5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline
PubChem CID18783998
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline
SMILESCOc1ccc(-c2nc3ccncc3[nH]2)c2ccc(C)nc12
InChIInChI=1S/C17H14N4O/c1-10-3-4-11-12(5-6-15(22-2)16(11)19-10)17-20-13-7-8-18-9-14(13)21-17/h3-9H,1-2H3,(H,20,21)
InChIKeyOOAGZITVPQUHTC-UHFFFAOYSA-N
XLogP3.49
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline?
The IUPAC name of 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline (CID 18783998) is 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline.
What is the SMILES notation for 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline?
The canonical SMILES for 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline is COc1ccc(-c2nc3ccncc3[nH]2)c2ccc(C)nc12.
What is the InChIKey of 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline?
The InChIKey is OOAGZITVPQUHTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-10-3-4-11-12(5-6-15(22-2)16(11)19-10)17-20-13-7-8-18-9-14(13)21-17/h3-9H,1-2H3,(H,20,21).
What are the key properties of 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline?
5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline has a molecular weight of 290.33 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3H-imidazo[4,5-c]pyridin-2-yl)-8-methoxy-2-methylquinoline is sourced from PubChem (CID 18783998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).