3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane

C15H24 — CID 144671945

IUPAC3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane
SMILESC.CC.CC1=Cc2ccc(C)cc2CC1
InChIInChI=1S/C12H14.C2H6.CH4/c1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-2;/h3,5,7-8H,4,6H2,1-2H3;1-2H3;1H4
InChIKeyKZVLKOBQQQRODM-UHFFFAOYSA-N
MW204.36 g/mol
LogP5.01
Rot. Bonds

About 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane

3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane (PubChem CID 144671945) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane.

Molecular Properties

Compound Name3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane
PubChem CID144671945
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane
SMILESC.CC.CC1=Cc2ccc(C)cc2CC1
InChIInChI=1S/C12H14.C2H6.CH4/c1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-2;/h3,5,7-8H,4,6H2,1-2H3;1-2H3;1H4
InChIKeyKZVLKOBQQQRODM-UHFFFAOYSA-N
XLogP5.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500204.36
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3,6-dimethyl-1,2-dihydronaphthalene;propane
CID 144809006
2,5-dimethyl-1H-indene;2,6-dimethyl-1H-indene
CID 90832270
2,7-dimethyl-3,4-dihydrophenanthrene
CID 142623853
2,7-dimethyl-9,10-dihydrophenanthrene
CID 23550290
7-methyl-1,2-dihydronaphthalene
CID 123252357
(4-methylphenyl) 6-methyl-3,4-dihydronaphthalene-2-carboxylate
CID 147597411
6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene
CID 10703379
2-methoxy-6-methyl-1H-indene
CID 58032012
5,14-dimethyltricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaene
CID 123351808
3,10-dimethyl-5,6,12,13-tetrahydronaphtho[1,2-b]phenanthrene
CID 21042275
bis(2,7-dimethyl-9H-fluorene);ethane;methane
CID 159270379
3,7-dimethyl-1,2-dihydroacridine
CID 70832048

Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane?
The IUPAC name of 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane (CID 144671945) is 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane.
What is the SMILES notation for 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane?
The canonical SMILES for 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane is C.CC.CC1=Cc2ccc(C)cc2CC1.
What is the InChIKey of 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane?
The InChIKey is KZVLKOBQQQRODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14.C2H6.CH4/c1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-2;/h3,5,7-8H,4,6H2,1-2H3;1-2H3;1H4.
What are the key properties of 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane?
3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane has a molecular weight of 204.36 g/mol, XLogP of 5.01, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane is sourced from PubChem (CID 144671945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).