methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol

C25H25NO3 — CID 142136276

IUPACmethanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol
SMILESCO.COc1ccc(-c2c(CO)n(/C=C/c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C24H21NO2.CH4O/c1-27-20-13-11-19(12-14-20)24-21-9-5-6-10-22(21)25(23(24)17-26)16-15-18-7-3-2-4-8-18;1-2/h2-16,26H,17H2,1H3;2H,1H3/b16-15+;
InChIKeySSJVNCHZFOWHPS-GEEYTBSJSA-N
MW387.48 g/mol
LogP5.05
Rot. Bonds5

About methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol

methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol (PubChem CID 142136276) has the molecular formula C25H25NO3 and a molecular weight of 387.48 g/mol. Its IUPAC name is methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol.

Molecular Properties

Compound Namemethanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol
PubChem CID142136276
Molecular FormulaC25H25NO3
Molecular Weight387.48 g/mol
Exact Mass387.18
IUPAC Namemethanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol
SMILESCO.COc1ccc(-c2c(CO)n(/C=C/c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C24H21NO2.CH4O/c1-27-20-13-11-19(12-14-20)24-21-9-5-6-10-22(21)25(23(24)17-26)16-15-18-7-3-2-4-8-18;1-2/h2-16,26H,17H2,1H3;2H,1H3/b16-15+;
InChIKeySSJVNCHZFOWHPS-GEEYTBSJSA-N
XLogP5.05
TPSA54.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

9-(2-phenylethenyl)carbazole
CID 3728958
1-(4-methoxyphenyl)-2-methyl-3-phenylindole
CID 102459165
5-(4-methoxyphenyl)-4-(4-methylphenyl)pyrrolo[1,2-a]quinoline
CID 53387757
[3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]indol-2-yl]methanol
CID 142136286
9-[4-(4-methoxyphenyl)phenyl]carbazole
CID 58905910
1-methoxy-4-(4-phenylbuta-1,3-dienyl)benzene
CID 4560156
1-[4-(4-methoxyphenyl)phenyl]-2,4,6-triphenyl-3,5-bis(4-phenylphenyl)benzene
CID 138981847
[1-(benzenesulfonyl)-3-(4-fluorophenyl)-5-methoxyindol-2-yl]methanol
CID 142660213
4-(4-methoxyphenyl)-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3-phenylthiochromenylium
CID 136743122
9-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethenyl]carbazole
CID 54402774
(E)-3-[10-(4-methoxyphenyl)anthracen-9-yl]prop-2-enoic acid
CID 132506737
1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
CID 54482883

Frequently Asked Questions

What is the IUPAC name of methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol?
The IUPAC name of methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol (CID 142136276) is methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol.
What is the SMILES notation for methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol?
The canonical SMILES for methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol is CO.COc1ccc(-c2c(CO)n(/C=C/c3ccccc3)c3ccccc23)cc1.
What is the InChIKey of methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol?
The InChIKey is SSJVNCHZFOWHPS-GEEYTBSJSA-N. The full InChI is InChI=1S/C24H21NO2.CH4O/c1-27-20-13-11-19(12-14-20)24-21-9-5-6-10-22(21)25(23(24)17-26)16-15-18-7-3-2-4-8-18;1-2/h2-16,26H,17H2,1H3;2H,1H3/b16-15+;.
What are the key properties of methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol?
methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol has a molecular weight of 387.48 g/mol, XLogP of 5.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;[3-(4-methoxyphenyl)-1-[(E)-2-phenylethenyl]indol-2-yl]methanol is sourced from PubChem (CID 142136276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).