1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol

C18H20FNO — CID 57213392

IUPAC1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol
SMILESCc1cccc(C2Cc3ccc(F)cc3C2CC(C)O)n1
InChIInChI=1S/C18H20FNO/c1-11-4-3-5-18(20-11)17-9-13-6-7-14(19)10-15(13)16(17)8-12(2)21/h3-7,10,12,16-17,21H,8-9H2,1-2H3
InChIKeyWSFZPLQBTLGARR-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.72
Rot. Bonds3

About 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol

1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol (PubChem CID 57213392) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol
PubChem CID57213392
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol
SMILESCc1cccc(C2Cc3ccc(F)cc3C2CC(C)O)n1
InChIInChI=1S/C18H20FNO/c1-11-4-3-5-18(20-11)17-9-13-6-7-14(19)10-15(13)16(17)8-12(2)21/h3-7,10,12,16-17,21H,8-9H2,1-2H3
InChIKeyWSFZPLQBTLGARR-UHFFFAOYSA-N
XLogP3.72
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol with MolForge

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Related Compounds

1-(13-fluoro-10-methyl-9-tricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaenyl)butan-2-ol
CID 23597668
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105373456
1-(5-fluoro-2,3-dihydro-1-benzothiophen-2-yl)propan-2-ol
CID 117200974
8-fluoro-4-methyl-1-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 114834413
(2S)-1-[(9R,10R)-10-azido-13-fluoro-9-tricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaenyl]butan-2-ol
CID 160679533
(2S)-1-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propan-2-ol
CID 103906577
(2R,9R)-6-fluoro-9-prop-2-enyltricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol
CID 91580718
2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine
CID 112716066
(3-fluorophenyl)-(6-methyl-2-pyridinyl)methanol
CID 63554167
(2S)-1-[(6-methyl-2-pyridinyl)oxy]propan-2-ol
CID 100911233
(2S,4S,6R)-4-ethyl-17-fluoro-3-oxatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),7,9,11,15,17-hexaene;(2R,4S,6S)-4-ethyl-17-fluoro-3-oxatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),7,9,11,15,17-hexaene;(2S,4R,6R)-4-ethyl-17-fluoro-3-oxatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),7,9,11,15,17-hexaene;(2R)-1-[(9R,10S)-13-fluoro-10-methyl-9-tricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaenyl]butan-2-ol;(2S)-1-[(9R,10S)-13-fluoro-10-methyl-9-tricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaenyl]butan-2-ol;(2R)-1-[(9S,10R)-13-fluoro-10-methyl-9-tricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaenyl]butan-2-ol;(2S)-1-[(9S,10R)-13-fluoro-10-methyl-9-tricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaenyl]butan-2-ol
CID 158021896
(1S)-1-[5-fluoro-2-(2-methylphenyl)sulfanylphenyl]ethanol
CID 78951488

Frequently Asked Questions

What is the IUPAC name of 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol?
The IUPAC name of 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol (CID 57213392) is 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol.
What is the SMILES notation for 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol?
The canonical SMILES for 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol is Cc1cccc(C2Cc3ccc(F)cc3C2CC(C)O)n1.
What is the InChIKey of 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol?
The InChIKey is WSFZPLQBTLGARR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c1-11-4-3-5-18(20-11)17-9-13-6-7-14(19)10-15(13)16(17)8-12(2)21/h3-7,10,12,16-17,21H,8-9H2,1-2H3.
What are the key properties of 1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol?
1-[6-fluoro-2-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol has a molecular weight of 285.36 g/mol, XLogP of 3.72, 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-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-inden-1-yl]propan-2-ol is sourced from PubChem (CID 57213392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).