[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol

C19H16N2O — CID 118449725

IUPAC[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol
SMILESCc1cccc2c(-c3ccc4c(CO)cccc4n3)c[nH]c12
InChIInChI=1S/C19H16N2O/c1-12-4-2-6-15-16(10-20-19(12)15)18-9-8-14-13(11-22)5-3-7-17(14)21-18/h2-10,20,22H,11H2,1H3
InChIKeyMLLWRROYWFKUMB-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.18
Rot. Bonds2

About [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol

[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol (PubChem CID 118449725) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol.

Molecular Properties

Compound Name[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol
PubChem CID118449725
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol
SMILESCc1cccc2c(-c3ccc4c(CO)cccc4n3)c[nH]c12
InChIInChI=1S/C19H16N2O/c1-12-4-2-6-15-16(10-20-19(12)15)18-9-8-14-13(11-22)5-3-7-17(14)21-18/h2-10,20,22H,11H2,1H3
InChIKeyMLLWRROYWFKUMB-UHFFFAOYSA-N
XLogP4.18
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol?
The IUPAC name of [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol (CID 118449725) is [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol.
What is the SMILES notation for [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol?
The canonical SMILES for [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol is Cc1cccc2c(-c3ccc4c(CO)cccc4n3)c[nH]c12.
What is the InChIKey of [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol?
The InChIKey is MLLWRROYWFKUMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c1-12-4-2-6-15-16(10-20-19(12)15)18-9-8-14-13(11-22)5-3-7-17(14)21-18/h2-10,20,22H,11H2,1H3.
What are the key properties of [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol?
[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol has a molecular weight of 288.35 g/mol, XLogP of 4.18, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol is sourced from PubChem (CID 118449725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).