(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol

C16H14FNO — CID 81445082

IUPAC(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol
SMILESCc1cc(F)ccc1C(O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H14FNO/c1-10-8-13(17)3-4-14(10)16(19)12-2-5-15-11(9-12)6-7-18-15/h2-9,16,18-19H,1H3
InChIKeyVEHKJQIPYRJVLW-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.70
Rot. Bonds2

About (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol

(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol (PubChem CID 81445082) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol
PubChem CID81445082
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol
SMILESCc1cc(F)ccc1C(O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H14FNO/c1-10-8-13(17)3-4-14(10)16(19)12-2-5-15-11(9-12)6-7-18-15/h2-9,16,18-19H,1H3
InChIKeyVEHKJQIPYRJVLW-UHFFFAOYSA-N
XLogP3.70
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(4-fluorophenyl)-(1H-indol-5-yl)methanol
CID 81444818
(3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol
CID 81444351
(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanol
CID 62791480
bis(4-fluoro-2-methylphenyl)methanol
CID 14371387
1H-indol-5-yl-(3,4,5-trifluorophenyl)methanol
CID 81444552
(4-fluoro-2-methylphenyl)-(4-iodophenyl)methanol
CID 115794222
(4-fluoro-2-methylphenyl)-(3-methylphenyl)methanol
CID 62791652
(3-fluoro-4-methoxyphenyl)-(1H-indol-5-yl)methanol
CID 81444916
1H-indol-5-yl(phenyl)methanol
CID 19042833
5-fluoro-1H-indole;molecular fluorine
CID 123133815
ethane;5-fluoro-1H-indole;molecular hydrogen
CID 144540127
(4-fluoro-2-methylphenyl)-(2-methyl-4-pyridinyl)methanol
CID 106756177

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol?
The IUPAC name of (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol (CID 81445082) is (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol.
What is the SMILES notation for (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol?
The canonical SMILES for (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol is Cc1cc(F)ccc1C(O)c1ccc2[nH]ccc2c1.
What is the InChIKey of (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol?
The InChIKey is VEHKJQIPYRJVLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-10-8-13(17)3-4-14(10)16(19)12-2-5-15-11(9-12)6-7-18-15/h2-9,16,18-19H,1H3.
What are the key properties of (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol?
(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol has a molecular weight of 255.29 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol is sourced from PubChem (CID 81445082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).