[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol

C18H19FO — CID 66058551

IUPAC[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
SMILESOCC1(Cc2cccc(F)c2)CCCc2ccccc21
InChIInChI=1S/C18H19FO/c19-16-8-3-5-14(11-16)12-18(13-20)10-4-7-15-6-1-2-9-17(15)18/h1-3,5-6,8-9,11,20H,4,7,10,12-13H2
InChIKeyRVABBVGJKRCFDT-UHFFFAOYSA-N
MW270.35 g/mol
LogP3.63
Rot. Bonds3

About [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol

[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol (PubChem CID 66058551) has the molecular formula C18H19FO and a molecular weight of 270.35 g/mol. Its IUPAC name is [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol.

Molecular Properties

Compound Name[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
PubChem CID66058551
Molecular FormulaC18H19FO
Molecular Weight270.35 g/mol
Exact Mass270.14
IUPAC Name[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
SMILESOCC1(Cc2cccc(F)c2)CCCc2ccccc21
InChIInChI=1S/C18H19FO/c19-16-8-3-5-14(11-16)12-18(13-20)10-4-7-15-6-1-2-9-17(15)18/h1-3,5-6,8-9,11,20H,4,7,10,12-13H2
InChIKeyRVABBVGJKRCFDT-UHFFFAOYSA-N
XLogP3.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-[(4-chloro-3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 107894915
(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 66059601
[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 66058133
4-[(3-bromo-4-fluorophenyl)methyl]-4-(bromomethyl)-2,3-dihydro-1H-naphthalene
CID 66048537
1-[1-[(3-chlorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]-N-methylmethanamine
CID 63501769
[1-[(4-chloro-3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 107897274
1-fluoro-3-[(1-fluorocyclopropyl)methyl]benzene
CID 84717270
4-(chloromethyl)-4-[(3,5-dimethylphenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66036331
4-(bromomethyl)-4-[(2-chloro-4-fluorophenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66049640
[1-[(2-methyltetrazol-5-yl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 107057773
4-(bromomethyl)-4-[(3,4-dichlorophenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66049410
4,4-diethyl-2,3-dihydro-1H-naphthalene
CID 520431

Frequently Asked Questions

What is the IUPAC name of [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
The IUPAC name of [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol (CID 66058551) is [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol.
What is the SMILES notation for [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
The canonical SMILES for [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol is OCC1(Cc2cccc(F)c2)CCCc2ccccc21.
What is the InChIKey of [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
The InChIKey is RVABBVGJKRCFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FO/c19-16-8-3-5-14(11-16)12-18(13-20)10-4-7-15-6-1-2-9-17(15)18/h1-3,5-6,8-9,11,20H,4,7,10,12-13H2.
What are the key properties of [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol has a molecular weight of 270.35 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol is sourced from PubChem (CID 66058551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).