cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone

C18H18O2 — CID 82553608

IUPACcyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone
SMILESCc1cc(OCc2ccccc2)ccc1C(=O)C1CC1
InChIInChI=1S/C18H18O2/c1-13-11-16(20-12-14-5-3-2-4-6-14)9-10-17(13)18(19)15-7-8-15/h2-6,9-11,15H,7-8,12H2,1H3
InChIKeyZYOXBMCQXHKNSH-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.17
Rot. Bonds5

About cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone

cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone (PubChem CID 82553608) has the molecular formula C18H18O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone.

Molecular Properties

Compound Namecyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone
PubChem CID82553608
Molecular FormulaC18H18O2
Molecular Weight266.34 g/mol
Exact Mass266.13
IUPAC Namecyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone
SMILESCc1cc(OCc2ccccc2)ccc1C(=O)C1CC1
InChIInChI=1S/C18H18O2/c1-13-11-16(20-12-14-5-3-2-4-6-14)9-10-17(13)18(19)15-7-8-15/h2-6,9-11,15H,7-8,12H2,1H3
InChIKeyZYOXBMCQXHKNSH-UHFFFAOYSA-N
XLogP4.17
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 ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclopropyl-(4-phenylmethoxyphenyl)methanone
CID 6482534
methyl 2-methyl-4-phenylmethoxybenzoate
CID 21194710
methyl 2-methyl-4-phenylmethoxybenzoate;2-methyl-4-phenylmethoxybenzoic acid
CID 159295589
3-methyl-1-(2-methyl-4-phenylmethoxyphenyl)butan-1-one
CID 146005137
(2-benzylsulfanyl-4-phenylmethoxyphenyl)-cyclohexylmethanone
CID 67313980
2,2,3,3,4,4,4-heptafluoro-1-(2-methyl-4-phenylmethoxyphenyl)butan-1-one
CID 146005146
N'-hydroxy-2-methyl-4-phenylmethoxybenzenecarboximidamide
CID 81278044
ethane;4-phenylmethoxyphthalic acid
CID 90802135
1-(2-bromo-4-phenylmethoxyphenyl)ethanone
CID 70433955
1-(2-methyl-4-phenylmethoxyphenyl)-2-thiophen-2-ylethanone
CID 146005163
methane;1-(2-methyl-4-phenylmethoxyphenyl)-2-(4-phenylmethoxyanilino)propan-1-one
CID 143735072
3-(2-methyl-4-phenylmethoxyphenyl)propanoic acid
CID 59522903

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone?
The IUPAC name of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone (CID 82553608) is cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone.
What is the SMILES notation for cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone?
The canonical SMILES for cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone is Cc1cc(OCc2ccccc2)ccc1C(=O)C1CC1.
What is the InChIKey of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone?
The InChIKey is ZYOXBMCQXHKNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O2/c1-13-11-16(20-12-14-5-3-2-4-6-14)9-10-17(13)18(19)15-7-8-15/h2-6,9-11,15H,7-8,12H2,1H3.
What are the key properties of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone?
cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone has a molecular weight of 266.34 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone is sourced from PubChem (CID 82553608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).