2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline

C19H16N2O — CID 118449001

IUPAC2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline
SMILESCOc1cccc2c(-c3cc(C)c4ccccc4n3)c[nH]c12
InChIInChI=1S/C19H16N2O/c1-12-10-17(21-16-8-4-3-6-13(12)16)15-11-20-19-14(15)7-5-9-18(19)22-2/h3-11,20H,1-2H3
InChIKeyANYRDRDLWHNOIB-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.70
Rot. Bonds2

About 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline

2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline (PubChem CID 118449001) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline.

Molecular Properties

Compound Name2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline
PubChem CID118449001
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline
SMILESCOc1cccc2c(-c3cc(C)c4ccccc4n3)c[nH]c12
InChIInChI=1S/C19H16N2O/c1-12-10-17(21-16-8-4-3-6-13(12)16)15-11-20-19-14(15)7-5-9-18(19)22-2/h3-11,20H,1-2H3
InChIKeyANYRDRDLWHNOIB-UHFFFAOYSA-N
XLogP4.70
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline?
The IUPAC name of 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline (CID 118449001) is 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline.
What is the SMILES notation for 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline?
The canonical SMILES for 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline is COc1cccc2c(-c3cc(C)c4ccccc4n3)c[nH]c12.
What is the InChIKey of 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline?
The InChIKey is ANYRDRDLWHNOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c1-12-10-17(21-16-8-4-3-6-13(12)16)15-11-20-19-14(15)7-5-9-18(19)22-2/h3-11,20H,1-2H3.
What are the key properties of 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline?
2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline has a molecular weight of 288.35 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline is sourced from PubChem (CID 118449001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).