[2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone

C18H18O2 — CID 14939960

IUPAC[2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone
SMILESCCOc1ccc(C2CC2C(=O)c2ccccc2)cc1
InChIInChI=1S/C18H18O2/c1-2-20-15-10-8-13(9-11-15)16-12-17(16)18(19)14-6-4-3-5-7-14/h3-11,16-17H,2,12H2,1H3
InChIKeyIQUMTLHPENUZMY-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.07
Rot. Bonds5

About [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone

[2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone (PubChem CID 14939960) has the molecular formula C18H18O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone.

Molecular Properties

Compound Name[2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone
PubChem CID14939960
Molecular FormulaC18H18O2
Molecular Weight266.34 g/mol
Exact Mass266.13
IUPAC Name[2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone
SMILESCCOc1ccc(C2CC2C(=O)c2ccccc2)cc1
InChIInChI=1S/C18H18O2/c1-2-20-15-10-8-13(9-11-15)16-12-17(16)18(19)14-6-4-3-5-7-14/h3-11,16-17H,2,12H2,1H3
InChIKeyIQUMTLHPENUZMY-UHFFFAOYSA-N
XLogP4.07
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-(4-ethoxyphenyl)cyclopropane-1-carboxylic acid
CID 39058010
[4-[3-(diethylamino)propoxy]phenyl]-(2-phenylcyclopropyl)methanone
CID 85424921
[(1R,2R)-2-(4-chlorophenyl)cyclopropyl]-phenylmethanone
CID 27327097
trans-ethyl (1R,2R)-2-(4-phenylmethoxyphenyl)cyclopropane-1-carboxylate
CID 66714771
(2-phenylcyclopropyl)-[4-(3-piperidin-1-ylpropoxy)phenyl]methanone
CID 72962194
2-[4-[2-(diethylamino)-2-oxoethoxy]phenyl]cyclopropane-1-carboxylic acid
CID 82228535
benzamide;1,4-diethoxybenzene
CID 162120306
[2-(4-ethoxyphenyl)-5-methoxycyclohexyl]-(3,4,5-trimethoxyphenyl)methanone
CID 22491332
(4-chlorophenyl)-[2-(4-methoxyphenyl)cyclopropyl]methanone
CID 14939961
ethyl 2-benzoylcyclopropane-1-carboxylate
CID 15568394
N-methyl-2-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 56787945
carbonochloridic acid;1-(2,2-dichlorocyclopropyl)-4-ethoxybenzene
CID 88752669

Frequently Asked Questions

What is the IUPAC name of [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone?
The IUPAC name of [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone (CID 14939960) is [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone.
What is the SMILES notation for [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone?
The canonical SMILES for [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone is CCOc1ccc(C2CC2C(=O)c2ccccc2)cc1.
What is the InChIKey of [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone?
The InChIKey is IQUMTLHPENUZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O2/c1-2-20-15-10-8-13(9-11-15)16-12-17(16)18(19)14-6-4-3-5-7-14/h3-11,16-17H,2,12H2,1H3.
What are the key properties of [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone?
[2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone has a molecular weight of 266.34 g/mol, XLogP of 4.07, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethoxyphenyl)cyclopropyl]-phenylmethanone is sourced from PubChem (CID 14939960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).