(2,3-dimethylphenyl)cyclodecane

C18H28 — CID 21161883

IUPAC(2,3-dimethylphenyl)cyclodecane
SMILESCc1cccc(C2CCCCCCCCC2)c1C
InChIInChI=1S/C18H28/c1-15-11-10-14-18(16(15)2)17-12-8-6-4-3-5-7-9-13-17/h10-11,14,17H,3-9,12-13H2,1-2H3
InChIKeyQHTOQTATYITYFY-UHFFFAOYSA-N
MW244.42 g/mol
LogP5.91
Rot. Bonds1

About (2,3-dimethylphenyl)cyclodecane

(2,3-dimethylphenyl)cyclodecane (PubChem CID 21161883) has the molecular formula C18H28 and a molecular weight of 244.42 g/mol. Its IUPAC name is (2,3-dimethylphenyl)cyclodecane.

Molecular Properties

Compound Name(2,3-dimethylphenyl)cyclodecane
PubChem CID21161883
Molecular FormulaC18H28
Molecular Weight244.42 g/mol
Exact Mass244.22
IUPAC Name(2,3-dimethylphenyl)cyclodecane
SMILESCc1cccc(C2CCCCCCCCC2)c1C
InChIInChI=1S/C18H28/c1-15-11-10-14-18(16(15)2)17-12-8-6-4-3-5-7-9-13-17/h10-11,14,17H,3-9,12-13H2,1-2H3
InChIKeyQHTOQTATYITYFY-UHFFFAOYSA-N
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500244.42
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-cyclopropyl-2,3-dimethylbenzene;ethane;formic acid
CID 144560479
CID 174102953
CID 174102953
3-cyclohexyl-2-methylbenzaldehyde
CID 15107628
2-cyclopentyl-6-methylbenzonitrile
CID 10559437
2,5-bis(2,6-dicyclohexylphenyl)-3,4-dimethylthiophene
CID 118656631
2,6-di(cycloheptyl)aniline
CID 156891849
1-chloro-3-cyclohexyl-2-methylbenzene;4-(3-chloro-2-methylphenyl)piperidine;hydrochloride
CID 163597059
1,2,3-tricyclohexyl-4-methylbenzene
CID 173149758
(2-cyclohexylphenyl)-(2-methylphenyl)methanone
CID 86030332
5-cyclohexyl-1,3-dimethylnaphthalene
CID 153456368
2-cyclopentyl-6-methylbenzoyl chloride
CID 144574773
trans-(1S,2R)-2-(2,3-dimethylphenyl)cyclopentan-1-ol
CID 91657986

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)cyclodecane?
The IUPAC name of (2,3-dimethylphenyl)cyclodecane (CID 21161883) is (2,3-dimethylphenyl)cyclodecane.
What is the SMILES notation for (2,3-dimethylphenyl)cyclodecane?
The canonical SMILES for (2,3-dimethylphenyl)cyclodecane is Cc1cccc(C2CCCCCCCCC2)c1C.
What is the InChIKey of (2,3-dimethylphenyl)cyclodecane?
The InChIKey is QHTOQTATYITYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28/c1-15-11-10-14-18(16(15)2)17-12-8-6-4-3-5-7-9-13-17/h10-11,14,17H,3-9,12-13H2,1-2H3.
What are the key properties of (2,3-dimethylphenyl)cyclodecane?
(2,3-dimethylphenyl)cyclodecane has a molecular weight of 244.42 g/mol, XLogP of 5.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)cyclodecane is sourced from PubChem (CID 21161883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).