[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol

C20H23FO2 — CID 143788779

IUPAC[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol
SMILESCCc1ccc(-c2cc(OC)ccc2F)c(C(O)C2(C)CC2)c1
InChIInChI=1S/C20H23FO2/c1-4-13-5-7-15(16-12-14(23-3)6-8-18(16)21)17(11-13)19(22)20(2)9-10-20/h5-8,11-12,19,22H,4,9-10H2,1-3H3
InChIKeyFUHOFZHDUPGDTN-UHFFFAOYSA-N
MW314.40 g/mol
LogP4.90
Rot. Bonds5

About [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol

[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol (PubChem CID 143788779) has the molecular formula C20H23FO2 and a molecular weight of 314.40 g/mol. Its IUPAC name is [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol.

Molecular Properties

Compound Name[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol
PubChem CID143788779
Molecular FormulaC20H23FO2
Molecular Weight314.40 g/mol
Exact Mass314.17
IUPAC Name[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol
SMILESCCc1ccc(-c2cc(OC)ccc2F)c(C(O)C2(C)CC2)c1
InChIInChI=1S/C20H23FO2/c1-4-13-5-7-15(16-12-14(23-3)6-8-18(16)21)17(11-13)19(22)20(2)9-10-20/h5-8,11-12,19,22H,4,9-10H2,1-3H3
InChIKeyFUHOFZHDUPGDTN-UHFFFAOYSA-N
XLogP4.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]propan-1-ol
CID 143789047
methyl (3R)-3-[2-fluoro-3-[[4-(2-fluoro-5-methoxyphenyl)-3-[(R)-hydroxy-(1-methylcyclopropyl)methyl]phenyl]methoxy]phenyl]-3-hydroxypropanoate
CID 71018733
methyl 3-[2-fluoro-3-[[4-(2-fluoro-5-methoxyphenyl)-3-[(R)-hydroxy-(1-methylcyclopropyl)methyl]phenyl]methoxy]phenyl]propanoate
CID 143789368
methyl (3R)-3-cyclopropyl-3-[2-fluoro-3-[[4-(2-fluoro-5-methoxyphenyl)-3-[hydroxy-(1-methylcyclopropyl)methyl]phenyl]methoxy]phenyl]propanoate
CID 143788825
ethane;1-[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-2,2-dimethylpropan-1-one
CID 143789443
methyl (3S)-3-[2-fluoro-3-[[4-(2-fluoro-5-methoxyphenyl)-3-[(S)-methoxy-(1-methylcyclopropyl)methyl]phenyl]methoxy]phenyl]hexanoate
CID 71018618
(2,5-diethylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 102884367
[3-[cyclopropyl(dimethylamino)methyl]-4-(2-fluoro-5-methoxyphenyl)phenyl]methanol;methyl 3-[cyclopropyl(dimethylamino)methyl]-4-(2-fluoro-5-methoxyphenyl)benzoate
CID 158661002
2-[4-(bromomethyl)-2-(5,5-dimethylcyclopenten-1-yl)phenyl]-1-fluoro-4-methoxybenzene;[3-(5,5-dimethylcyclopenten-1-yl)-4-(2-fluoro-5-methoxyphenyl)phenyl]methanol
CID 158825208
2-(2-fluoro-5-methoxyphenyl)-5-(hydroxymethyl)benzoic acid
CID 57467590
4-ethyl-2-fluoro-1-(4-methoxyphenyl)benzene
CID 146522341
CID 161421719
CID 161421719

Frequently Asked Questions

What is the IUPAC name of [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol?
The IUPAC name of [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol (CID 143788779) is [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol.
What is the SMILES notation for [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol?
The canonical SMILES for [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol is CCc1ccc(-c2cc(OC)ccc2F)c(C(O)C2(C)CC2)c1.
What is the InChIKey of [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol?
The InChIKey is FUHOFZHDUPGDTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FO2/c1-4-13-5-7-15(16-12-14(23-3)6-8-18(16)21)17(11-13)19(22)20(2)9-10-20/h5-8,11-12,19,22H,4,9-10H2,1-3H3.
What are the key properties of [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol?
[5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol has a molecular weight of 314.40 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-ethyl-2-(2-fluoro-5-methoxyphenyl)phenyl]-(1-methylcyclopropyl)methanol is sourced from PubChem (CID 143788779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).