(2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol

C17H16Cl2O — CID 63414305

IUPAC(2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol
SMILESOC(c1cccc(Cl)c1Cl)C1(c2ccccc2)CCC1
InChIInChI=1S/C17H16Cl2O/c18-14-9-4-8-13(15(14)19)16(20)17(10-5-11-17)12-6-2-1-3-7-12/h1-4,6-9,16,20H,5,10-11H2
InChIKeyUPECIXLIXYNGKH-UHFFFAOYSA-N
MW307.22 g/mol
LogP5.15
Rot. Bonds3

About (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol

(2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol (PubChem CID 63414305) has the molecular formula C17H16Cl2O and a molecular weight of 307.22 g/mol. Its IUPAC name is (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol.

Molecular Properties

Compound Name(2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol
PubChem CID63414305
Molecular FormulaC17H16Cl2O
Molecular Weight307.22 g/mol
Exact Mass306.06
IUPAC Name(2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol
SMILESOC(c1cccc(Cl)c1Cl)C1(c2ccccc2)CCC1
InChIInChI=1S/C17H16Cl2O/c18-14-9-4-8-13(15(14)19)16(20)17(10-5-11-17)12-6-2-1-3-7-12/h1-4,6-9,16,20H,5,10-11H2
InChIKeyUPECIXLIXYNGKH-UHFFFAOYSA-N
XLogP5.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.22
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol 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

(2-chlorophenyl)-(1-phenylcyclohexyl)methanol
CID 63414657
(2-chloro-5-fluorophenyl)-(1-phenylcyclopropyl)methanol
CID 105394462
(3-chlorothiophen-2-yl)-(1-phenylcyclopentyl)methanol
CID 107359518
1-benzothiophen-7-yl-(1-phenylcyclobutyl)methanol
CID 81129786
N-[(2,3-dichlorophenyl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 63417837
1-[(2,3-dichlorophenyl)-hydroxymethyl]cyclooctane-1-carbonitrile
CID 80603678
(2-chloro-4-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol
CID 81044939
2,3-dihydro-1-benzofuran-7-yl-(1-phenylcyclopropyl)methanol
CID 114744527
[1-(aminomethyl)-3-ethylcyclohexyl]-(2,3-dichlorophenyl)methanol
CID 79138325
(2-ethoxyphenyl)-(1-phenylcyclopropyl)methanol
CID 63079301
1-[(2,3-dichlorophenyl)-hydroxymethyl]-4-ethylcyclohexane-1-carbonitrile
CID 79136780
cyclobutyl-(2,3-dichlorophenyl)methanol
CID 64986948

Frequently Asked Questions

What is the IUPAC name of (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol?
The IUPAC name of (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol (CID 63414305) is (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol.
What is the SMILES notation for (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol?
The canonical SMILES for (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol is OC(c1cccc(Cl)c1Cl)C1(c2ccccc2)CCC1.
What is the InChIKey of (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol?
The InChIKey is UPECIXLIXYNGKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2O/c18-14-9-4-8-13(15(14)19)16(20)17(10-5-11-17)12-6-2-1-3-7-12/h1-4,6-9,16,20H,5,10-11H2.
What are the key properties of (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol?
(2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol has a molecular weight of 307.22 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dichlorophenyl)-(1-phenylcyclobutyl)methanol is sourced from PubChem (CID 63414305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).