1-methoxy-4-(3-phenylcyclobutyl)benzene

C17H18O — CID 125465439

IUPAC1-methoxy-4-(3-phenylcyclobutyl)benzene
SMILESCOc1ccc(C2CC(c3ccccc3)C2)cc1
InChIInChI=1S/C17H18O/c1-18-17-9-7-14(8-10-17)16-11-15(12-16)13-5-3-2-4-6-13/h2-10,15-16H,11-12H2,1H3
InChIKeyAPZRZNQVMUTXBR-UHFFFAOYSA-N
MW238.33 g/mol
LogP4.36
Rot. Bonds3

About 1-methoxy-4-(3-phenylcyclobutyl)benzene

1-methoxy-4-(3-phenylcyclobutyl)benzene (PubChem CID 125465439) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-methoxy-4-(3-phenylcyclobutyl)benzene.

Molecular Properties

Compound Name1-methoxy-4-(3-phenylcyclobutyl)benzene
PubChem CID125465439
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-methoxy-4-(3-phenylcyclobutyl)benzene
SMILESCOc1ccc(C2CC(c3ccccc3)C2)cc1
InChIInChI=1S/C17H18O/c1-18-17-9-7-14(8-10-17)16-11-15(12-16)13-5-3-2-4-6-13/h2-10,15-16H,11-12H2,1H3
InChIKeyAPZRZNQVMUTXBR-UHFFFAOYSA-N
XLogP4.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-methoxyphenyl)cyclobutane-1-carboxylic acid
CID 67514282
1-(3-ethylcyclobutyl)-4-methoxybenzene
CID 166481315
(4-methoxyphenyl)-(4-phenyliodoniophenyl)iodanium
CID 10259813
1-[(1S,2R,3R,4S)-2,3-dimethyl-4-phenylcyclobutyl]-4-methoxybenzene
CID 134955785
(4-methoxyphenyl)-phenyliodanium bromide
CID 11058256
N-[3-(4-methoxyphenyl)cyclobutyl]-2-methylsulfanylaniline
CID 43683508
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
3-(4-methoxyphenyl)-1-methylazetidine
CID 134399978
(4-methoxyphenyl)-(3-phenyliodonio-2-bicyclo[2.2.1]hepta-2,5-dienyl)iodanium
CID 157388486
N-(2-ethylcyclopropyl)-3-(4-methoxyphenyl)cyclobutan-1-amine
CID 114107711
[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine
CID 24738284
N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine
CID 43633186

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-(3-phenylcyclobutyl)benzene?
The IUPAC name of 1-methoxy-4-(3-phenylcyclobutyl)benzene (CID 125465439) is 1-methoxy-4-(3-phenylcyclobutyl)benzene.
What is the SMILES notation for 1-methoxy-4-(3-phenylcyclobutyl)benzene?
The canonical SMILES for 1-methoxy-4-(3-phenylcyclobutyl)benzene is COc1ccc(C2CC(c3ccccc3)C2)cc1.
What is the InChIKey of 1-methoxy-4-(3-phenylcyclobutyl)benzene?
The InChIKey is APZRZNQVMUTXBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-18-17-9-7-14(8-10-17)16-11-15(12-16)13-5-3-2-4-6-13/h2-10,15-16H,11-12H2,1H3.
What are the key properties of 1-methoxy-4-(3-phenylcyclobutyl)benzene?
1-methoxy-4-(3-phenylcyclobutyl)benzene has a molecular weight of 238.33 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-(3-phenylcyclobutyl)benzene is sourced from PubChem (CID 125465439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).