[(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol

C18H20O2 — CID 125473550

IUPAC[(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol
SMILESCCO[C@@H]1C[C@@H]1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20O2/c1-2-20-17-13-16(17)18(19,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17,19H,2,13H2,1H3/t16-,17+/m0/s1
InChIKeyDUXVQOOVYWAZNW-DLBZAZTESA-N
MW268.36 g/mol
LogP3.35
Rot. Bonds5

About [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol

[(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol (PubChem CID 125473550) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol.

Molecular Properties

Compound Name[(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol
PubChem CID125473550
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name[(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol
SMILESCCO[C@@H]1C[C@@H]1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20O2/c1-2-20-17-13-16(17)18(19,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17,19H,2,13H2,1H3/t16-,17+/m0/s1
InChIKeyDUXVQOOVYWAZNW-DLBZAZTESA-N
XLogP3.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethoxyethane;triphenylmethanol
CID 70428584
[(3S)-1-ethyl-1-azoniabicyclo[2.2.2]octan-3-yl]-diphenylmethanol
CID 1386014
[(4S,5R)-2,2-diethyl-5-[hydroxy(diphenyl)methyl]-1,3-dioxolan-4-yl]-diphenylmethanol
CID 27794609
[(2S)-1-methylaziridin-2-yl]-diphenylmethanol
CID 101268186
ethyl (3aR,8bR)-3-hydroxy-2-[hydroxy(diphenyl)methyl]-1,2,3a,8b-tetrahydropyrrolo[2,3-b]indole-4-carboxylate
CID 134501631
[2-(dimethylamino)cyclohexyl]-diphenylmethanol
CID 11971775
[(2S,4R)-4-methyl-1-oxothietan-2-yl]-diphenylmethanol
CID 132553835
diphenyl-[(1S,2S)-2-pyridin-4-ylcyclopropyl]methanol
CID 92533340
ethyl 2-hydroxy-2,2-diphenylethanimidate
CID 139840851
1-(oxiran-2-yl)-2-phenylpropan-2-ol
CID 11644018
1-[ethoxy(methyl)amino]-1-phenylethanol
CID 88599607
[1-(2-methylpropyl)piperidin-4-yl]-diphenylmethanol
CID 174760592

Frequently Asked Questions

What is the IUPAC name of [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol?
The IUPAC name of [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol (CID 125473550) is [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol.
What is the SMILES notation for [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol?
The canonical SMILES for [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol is CCO[C@@H]1C[C@@H]1C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol?
The InChIKey is DUXVQOOVYWAZNW-DLBZAZTESA-N. The full InChI is InChI=1S/C18H20O2/c1-2-20-17-13-16(17)18(19,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17,19H,2,13H2,1H3/t16-,17+/m0/s1.
What are the key properties of [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol?
[(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol has a molecular weight of 268.36 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2R)-2-ethoxycyclopropyl]-diphenylmethanol is sourced from PubChem (CID 125473550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).