1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol

C17H18FNO — CID 103873387

IUPAC1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol
SMILESCC(O)(CN1CCc2ccc(F)cc21)c1ccccc1
InChIInChI=1S/C17H18FNO/c1-17(20,14-5-3-2-4-6-14)12-19-10-9-13-7-8-15(18)11-16(13)19/h2-8,11,20H,9-10,12H2,1H3
InChIKeyLBNHDDGHZMMVHI-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.10
Rot. Bonds3

About 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol

1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol (PubChem CID 103873387) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol.

Molecular Properties

Compound Name1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol
PubChem CID103873387
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC Name1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol
SMILESCC(O)(CN1CCc2ccc(F)cc21)c1ccccc1
InChIInChI=1S/C17H18FNO/c1-17(20,14-5-3-2-4-6-14)12-19-10-9-13-7-8-15(18)11-16(13)19/h2-8,11,20H,9-10,12H2,1H3
InChIKeyLBNHDDGHZMMVHI-UHFFFAOYSA-N
XLogP3.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethylamino)-3-(6-fluoro-2,3-dihydroindol-1-yl)-2-methylpropanoic acid
CID 103501934
2-amino-1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-1-one
CID 103495274
3-(6-fluoro-2,3-dihydroindol-1-yl)-2-methyl-2-(propan-2-ylamino)propanamide
CID 103501897
2-cyclopropyl-3-(6-fluoro-2,3-dihydroindol-1-yl)-2-(methylamino)propan-1-ol
CID 103503991
4-(6-fluoro-2,3-dihydroindol-1-yl)-2,2-dimethylbutanethioamide
CID 103495730
N-[2-(6-fluoro-2,3-dihydroindol-1-yl)ethyl]-2-methylaniline
CID 103503442
CID 158124284
CID 158124284
1-(5-fluoro-2,3-dihydroindol-1-yl)-2-methylpropan-2-amine
CID 120847632
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-2-methyl-N-propan-2-ylpentan-1-amine
CID 103502593
(3R)-4-(6-fluoro-2,3-dihydroindol-1-yl)-3-methylbutan-2-one
CID 146175141
4-(6-fluoro-2,3-dihydroindol-1-yl)-2-methyl-2-(propan-2-ylamino)butanoic acid
CID 103501908
3,5-difluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)benzoic acid
CID 103496505

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol?
The IUPAC name of 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol (CID 103873387) is 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol.
What is the SMILES notation for 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol?
The canonical SMILES for 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol is CC(O)(CN1CCc2ccc(F)cc21)c1ccccc1.
What is the InChIKey of 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol?
The InChIKey is LBNHDDGHZMMVHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-17(20,14-5-3-2-4-6-14)12-19-10-9-13-7-8-15(18)11-16(13)19/h2-8,11,20H,9-10,12H2,1H3.
What are the key properties of 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol?
1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol has a molecular weight of 271.34 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-2,3-dihydroindol-1-yl)-2-phenylpropan-2-ol is sourced from PubChem (CID 103873387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).