4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one

C18H26O2 — CID 143822953

IUPAC4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one
SMILESCOc1ccc(CCCC(=O)C2(C(C)C)CCC2)cc1
InChIInChI=1S/C18H26O2/c1-14(2)18(12-5-13-18)17(19)7-4-6-15-8-10-16(20-3)11-9-15/h8-11,14H,4-7,12-13H2,1-3H3
InChIKeyJQQXJYINOCIMLO-UHFFFAOYSA-N
MW274.40 g/mol
LogP4.41
Rot. Bonds7

About 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one

4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one (PubChem CID 143822953) has the molecular formula C18H26O2 and a molecular weight of 274.40 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one
PubChem CID143822953
Molecular FormulaC18H26O2
Molecular Weight274.40 g/mol
Exact Mass274.19
IUPAC Name4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one
SMILESCOc1ccc(CCCC(=O)C2(C(C)C)CCC2)cc1
InChIInChI=1S/C18H26O2/c1-14(2)18(12-5-13-18)17(19)7-4-6-15-8-10-16(20-3)11-9-15/h8-11,14H,4-7,12-13H2,1-3H3
InChIKeyJQQXJYINOCIMLO-UHFFFAOYSA-N
XLogP4.41
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one 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

4-(4-methoxyphenyl)-1-(1-methylcyclopropyl)butan-1-one
CID 175624842
N-[1-(iodomethyl)cyclopropyl]-4-(4-methoxyphenyl)butanamide
CID 90297722
1-cyclopentyl-4-(4-methoxyphenyl)butan-1-one
CID 113390085
1-(1-ethoxycyclopentyl)-3-(4-methoxyphenyl)propan-1-one
CID 116747836
5-(4-methoxyphenyl)pentanoyl chloride
CID 21497235
1-(1-methoxycycloheptyl)-3-(4-methoxyphenyl)propan-1-one
CID 116750532
1-amino-N-[4-(4-methoxyphenyl)butan-2-yl]cyclopentane-1-carboxamide
CID 119288107
N-hydroxy-4-(4-methoxyphenyl)butanamide
CID 53384800
2-[4-(4-methoxyphenyl)butanoyl-methylamino]propanoic acid
CID 119208828
1-[2-(4-methoxyphenyl)ethyl]-3-propan-2-ylpyrrolidine-3-carboxylic acid
CID 106984211
5-(4-methoxyphenyl)pentanamide
CID 134389506
(4R)-1,4-bis(4-methoxyphenyl)pentan-3-one
CID 166438923

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one?
The IUPAC name of 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one (CID 143822953) is 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one.
What is the SMILES notation for 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one?
The canonical SMILES for 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one is COc1ccc(CCCC(=O)C2(C(C)C)CCC2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one?
The InChIKey is JQQXJYINOCIMLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O2/c1-14(2)18(12-5-13-18)17(19)7-4-6-15-8-10-16(20-3)11-9-15/h8-11,14H,4-7,12-13H2,1-3H3.
What are the key properties of 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one?
4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one has a molecular weight of 274.40 g/mol, XLogP of 4.41, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1-(1-propan-2-ylcyclobutyl)butan-1-one is sourced from PubChem (CID 143822953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).