2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol

C16H16FNO — CID 65041648

IUPAC2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol
SMILESCc1ccc(C(O)C2Cc3ccccc3N2)cc1F
InChIInChI=1S/C16H16FNO/c1-10-6-7-12(8-13(10)17)16(19)15-9-11-4-2-3-5-14(11)18-15/h2-8,15-16,18-19H,9H2,1H3
InChIKeyLGLBDGUHDIONLO-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.20
Rot. Bonds2

About 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol

2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol (PubChem CID 65041648) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol
PubChem CID65041648
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol
SMILESCc1ccc(C(O)C2Cc3ccccc3N2)cc1F
InChIInChI=1S/C16H16FNO/c1-10-6-7-12(8-13(10)17)16(19)15-9-11-4-2-3-5-14(11)18-15/h2-8,15-16,18-19H,9H2,1H3
InChIKeyLGLBDGUHDIONLO-UHFFFAOYSA-N
XLogP3.20
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3-chloro-4-methylphenyl)-(2,3-dihydro-1H-indol-2-yl)methanol
CID 106818099
2,3-dihydro-1H-indol-2-yl-(4-methylphenyl)methanol
CID 3825939
2,3-dihydro-1H-inden-2-yl-(3-fluoro-4-methylphenyl)methanol
CID 107128521
(3-fluoro-4-methoxyphenyl)-(1,2,3,4-tetrahydroquinolin-2-yl)methanol
CID 65101161
2,3-dihydro-1H-indol-2-yl(pyridin-3-yl)methanol
CID 65042396
(2,4-dichlorophenyl)-(2,3-dihydro-1H-indol-2-yl)methanol
CID 65042297
cyclopropyl(2,3-dihydro-1H-indol-2-yl)methanol
CID 65041649
2,3-dihydro-1H-indol-2-yl-(2-methylpyrimidin-4-yl)methanol
CID 115527971
(4-fluoro-2-methylphenyl)-(1,2,3,4-tetrahydroquinolin-2-yl)methanol
CID 65041819
(5-bromothiophen-2-yl)-(2,3-dihydro-1H-indol-2-yl)methanol
CID 65042831
(2S)-N-[(3-fluoro-4-methylphenyl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 61155551
2,3-dihydro-1,4-benzodioxin-3-yl-(3-fluoro-4-methylphenyl)methanol
CID 107128510

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol?
The IUPAC name of 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol (CID 65041648) is 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol?
The canonical SMILES for 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol is Cc1ccc(C(O)C2Cc3ccccc3N2)cc1F.
What is the InChIKey of 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol?
The InChIKey is LGLBDGUHDIONLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-10-6-7-12(8-13(10)17)16(19)15-9-11-4-2-3-5-14(11)18-15/h2-8,15-16,18-19H,9H2,1H3.
What are the key properties of 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol?
2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol has a molecular weight of 257.31 g/mol, XLogP of 3.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indol-2-yl-(3-fluoro-4-methylphenyl)methanol is sourced from PubChem (CID 65041648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).