[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol

C20H17NO — CID 159141056

IUPAC[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol
SMILESCc1cccc2c1CC=C2c1ccc2c(CO)cccc2n1
InChIInChI=1S/C20H17NO/c1-13-4-2-6-17-15(13)8-9-18(17)20-11-10-16-14(12-22)5-3-7-19(16)21-20/h2-7,9-11,22H,8,12H2,1H3
InChIKeyVFCOKYNOAUOPLU-UHFFFAOYSA-N
MW287.36 g/mol
LogP4.02
Rot. Bonds2

About [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol

[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol (PubChem CID 159141056) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol.

Molecular Properties

Compound Name[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol
PubChem CID159141056
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol
SMILESCc1cccc2c1CC=C2c1ccc2c(CO)cccc2n1
InChIInChI=1S/C20H17NO/c1-13-4-2-6-17-15(13)8-9-18(17)20-11-10-16-14(12-22)5-3-7-19(16)21-20/h2-7,9-11,22H,8,12H2,1H3
InChIKeyVFCOKYNOAUOPLU-UHFFFAOYSA-N
XLogP4.02
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methyl-3H-inden-1-yl)-5-(trifluoromethyl)quinoline
CID 148529196
[2-(7-methyl-1H-indol-3-yl)quinolin-5-yl]methanol
CID 118449725
2-(4-bromo-3H-inden-1-yl)-5-fluoroquinoline
CID 162251519
5-methyl-2-(5-methylquinolin-2-yl)quinoline
CID 100918758
3-[2-(hydroxymethyl)-6-methylphenoxy]propane-1,2-diol
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2,5-bis(4-phenylnaphthalen-1-yl)quinoline
CID 163839918
2-(2,6-diethylphenyl)-4-methylquinoline
CID 101498276
3-tert-butyl-7-methyl-1H-indene
CID 159200998
[2-[(2R)-2-aminopropoxy]-3-methylphenyl]methanol;oxalic acid
CID 171380777
[6-(hydroxymethyl)phenazin-1-yl]methanol
CID 44607162
1,1,1-trifluoro-3-[2-(hydroxymethyl)-6-methylphenoxy]propan-2-ol
CID 112612406
[2-(6-methyl-2-phenylpyrimidin-4-yl)phenyl]methanol
CID 56719373

Frequently Asked Questions

What is the IUPAC name of [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol?
The IUPAC name of [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol (CID 159141056) is [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol.
What is the SMILES notation for [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol?
The canonical SMILES for [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol is Cc1cccc2c1CC=C2c1ccc2c(CO)cccc2n1.
What is the InChIKey of [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol?
The InChIKey is VFCOKYNOAUOPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c1-13-4-2-6-17-15(13)8-9-18(17)20-11-10-16-14(12-22)5-3-7-19(16)21-20/h2-7,9-11,22H,8,12H2,1H3.
What are the key properties of [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol?
[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol has a molecular weight of 287.36 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol is sourced from PubChem (CID 159141056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).