cyclobutyl-(3,4-dichlorophenyl)methanone

C11H10Cl2O — CID 24724150

IUPACcyclobutyl-(3,4-dichlorophenyl)methanone
SMILESO=C(c1ccc(Cl)c(Cl)c1)C1CCC1
InChIInChI=1S/C11H10Cl2O/c12-9-5-4-8(6-10(9)13)11(14)7-2-1-3-7/h4-7H,1-3H2
InChIKeyIWXVLJAVZHYAAF-UHFFFAOYSA-N
MW229.11 g/mol
LogP3.98
Rot. Bonds2

About cyclobutyl-(3,4-dichlorophenyl)methanone

cyclobutyl-(3,4-dichlorophenyl)methanone (PubChem CID 24724150) has the molecular formula C11H10Cl2O and a molecular weight of 229.11 g/mol. Its IUPAC name is cyclobutyl-(3,4-dichlorophenyl)methanone.

Molecular Properties

Compound Namecyclobutyl-(3,4-dichlorophenyl)methanone
PubChem CID24724150
Molecular FormulaC11H10Cl2O
Molecular Weight229.11 g/mol
Exact Mass228.01
IUPAC Namecyclobutyl-(3,4-dichlorophenyl)methanone
SMILESO=C(c1ccc(Cl)c(Cl)c1)C1CCC1
InChIInChI=1S/C11H10Cl2O/c12-9-5-4-8(6-10(9)13)11(14)7-2-1-3-7/h4-7H,1-3H2
InChIKeyIWXVLJAVZHYAAF-UHFFFAOYSA-N
XLogP3.98
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.11
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze cyclobutyl-(3,4-dichlorophenyl)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

cyclohexyl-(3,4-dichlorophenyl)methanone
CID 11601310
cycloheptyl-(3,4-dichlorophenyl)methanone
CID 63490974
cyclopropyl-(3,4-dichlorophenyl)methanone
CID 19806646
2-chloro-4-(cyclobutanecarbonyl)benzonitrile
CID 138109981
[4-chloro-3-(trifluoromethyl)phenyl]-cyclohexylmethanone
CID 94299802
(3,4-dichlorophenyl)-(oxiran-2-yl)methanone
CID 116826504
(3,4-dichlorophenyl)-[1-[(1S,2S)-2-methylcyclopropanecarbonyl]piperidin-4-yl]methanone
CID 94796993
1-[3-[4-(3,4-dichlorobenzoyl)piperidine-1-carbonyl]piperidin-1-yl]propan-1-one
CID 55980544
3-(cyclobutanecarbonyl)benzoyl chloride
CID 123709690
(4-chloro-3-methoxyphenyl)-cyclopropylmethanone
CID 79700352
(3,4-dichlorophenyl)-[(2S)-2,3-dimethylcyclopropyl]methanone
CID 126593158
N-[3-[4-(3,4-dichlorobenzoyl)piperidine-1-carbonyl]phenyl]cyclohexanecarboxamide
CID 55955366

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(3,4-dichlorophenyl)methanone?
The IUPAC name of cyclobutyl-(3,4-dichlorophenyl)methanone (CID 24724150) is cyclobutyl-(3,4-dichlorophenyl)methanone.
What is the SMILES notation for cyclobutyl-(3,4-dichlorophenyl)methanone?
The canonical SMILES for cyclobutyl-(3,4-dichlorophenyl)methanone is O=C(c1ccc(Cl)c(Cl)c1)C1CCC1.
What is the InChIKey of cyclobutyl-(3,4-dichlorophenyl)methanone?
The InChIKey is IWXVLJAVZHYAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2O/c12-9-5-4-8(6-10(9)13)11(14)7-2-1-3-7/h4-7H,1-3H2.
What are the key properties of cyclobutyl-(3,4-dichlorophenyl)methanone?
cyclobutyl-(3,4-dichlorophenyl)methanone has a molecular weight of 229.11 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(3,4-dichlorophenyl)methanone is sourced from PubChem (CID 24724150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).