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

C16H14FNO — CID 81444351

IUPAC(3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol
SMILESCc1ccc(C(O)c2ccc3[nH]ccc3c2)cc1F
InChIInChI=1S/C16H14FNO/c1-10-2-3-13(9-14(10)17)16(19)12-4-5-15-11(8-12)6-7-18-15/h2-9,16,18-19H,1H3
InChIKeyONQYFHUPMVTQLL-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.70
Rot. Bonds2

About (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol

(3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol (PubChem CID 81444351) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol
PubChem CID81444351
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name(3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol
SMILESCc1ccc(C(O)c2ccc3[nH]ccc3c2)cc1F
InChIInChI=1S/C16H14FNO/c1-10-2-3-13(9-14(10)17)16(19)12-4-5-15-11(8-12)6-7-18-15/h2-9,16,18-19H,1H3
InChIKeyONQYFHUPMVTQLL-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

1H-indol-5-yl-(3,4,5-trifluorophenyl)methanol
CID 81444552
(4-fluorophenyl)-(1H-indol-5-yl)methanol
CID 81444818
(3-fluoro-4-methoxyphenyl)-(1H-indol-5-yl)methanol
CID 81444916
(4-fluoro-2-methylphenyl)-(1H-indol-5-yl)methanol
CID 81445082
1H-indol-5-yl(phenyl)methanol
CID 19042833
5-[(3-fluoro-4-methylphenyl)-hydroxymethyl]-1,3-dihydrobenzimidazol-2-one
CID 61086954
(3-fluoro-4-methylphenyl)-(4-methoxyphenyl)methanol
CID 60798694
1H-indol-5-yl-(3-methoxyphenyl)methanol
CID 81444817
(4-chloro-3-methylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130625
5-propan-2-yl-1H-indole
CID 10558918
(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287290
(3-fluoro-4-methylphenyl)-pyrimidin-5-ylmethanol
CID 62490525

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol?
The IUPAC name of (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol (CID 81444351) is (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol?
The canonical SMILES for (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol is Cc1ccc(C(O)c2ccc3[nH]ccc3c2)cc1F.
What is the InChIKey of (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol?
The InChIKey is ONQYFHUPMVTQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-10-2-3-13(9-14(10)17)16(19)12-4-5-15-11(8-12)6-7-18-15/h2-9,16,18-19H,1H3.
What are the key properties of (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol?
(3-fluoro-4-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 (3-fluoro-4-methylphenyl)-(1H-indol-5-yl)methanol is sourced from PubChem (CID 81444351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).