1,5-dimethyl-3-phenylnaphthalene

C18H16 — CID 171720915

IUPAC1,5-dimethyl-3-phenylnaphthalene
SMILESCc1cc(-c2ccccc2)cc2c(C)cccc12
InChIInChI=1S/C18H16/c1-13-7-6-10-17-14(2)11-16(12-18(13)17)15-8-4-3-5-9-15/h3-12H,1-2H3
InChIKeyAYKDKPAZMLOLQF-UHFFFAOYSA-N
MW232.33 g/mol
LogP5.12
Rot. Bonds1

About 1,5-dimethyl-3-phenylnaphthalene

1,5-dimethyl-3-phenylnaphthalene (PubChem CID 171720915) has the molecular formula C18H16 and a molecular weight of 232.33 g/mol. Its IUPAC name is 1,5-dimethyl-3-phenylnaphthalene.

Molecular Properties

Compound Name1,5-dimethyl-3-phenylnaphthalene
PubChem CID171720915
Molecular FormulaC18H16
Molecular Weight232.33 g/mol
Exact Mass232.13
IUPAC Name1,5-dimethyl-3-phenylnaphthalene
SMILESCc1cc(-c2ccccc2)cc2c(C)cccc12
InChIInChI=1S/C18H16/c1-13-7-6-10-17-14(2)11-16(12-18(13)17)15-8-4-3-5-9-15/h3-12H,1-2H3
InChIKeyAYKDKPAZMLOLQF-UHFFFAOYSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500232.33
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,5-dimethylnaphthalene
CID 162159355
1,2,4-trimethyl-7-phenylnaphthalene
CID 166008458
1-methyl-3-(4-methylnaphthalen-2-yl)naphthalene
CID 58049667
2-[2-methyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]triphenylene
CID 123442810
12-methyl-5-phenyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaen-2-one
CID 15980956
1,3-dimethylnaphthalene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;1,3-dimethyl-5-phenylbenzene;1,2,3,4,5,6-hexamethylbenzene;1-methyl-4-(4-methylphenyl)benzene;1,2,4,5-tetramethylbenzene;1,3-xylene;1,4-xylene
CID 159076135
5-methyl-3-phenylisoquinolin-1-amine
CID 58517503
anthracene;tris(1,1'-biphenyl);ethane;1-methylnaphthalene;phenanthrene;toluene
CID 161034460
2-[3-[3-(3-phenylphenyl)phenyl]-5-[3-(4-phenylphenyl)phenyl]phenyl]triphenylene
CID 167425257
2,6-dimethyl-4-(4-phenylphenyl)phenol
CID 22900078
2-methoxy-3-methyl-5-phenylphenol
CID 132557865
1,5-dimethyl-3-propan-2-ylnaphthalene
CID 102239796

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-3-phenylnaphthalene?
The IUPAC name of 1,5-dimethyl-3-phenylnaphthalene (CID 171720915) is 1,5-dimethyl-3-phenylnaphthalene.
What is the SMILES notation for 1,5-dimethyl-3-phenylnaphthalene?
The canonical SMILES for 1,5-dimethyl-3-phenylnaphthalene is Cc1cc(-c2ccccc2)cc2c(C)cccc12.
What is the InChIKey of 1,5-dimethyl-3-phenylnaphthalene?
The InChIKey is AYKDKPAZMLOLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16/c1-13-7-6-10-17-14(2)11-16(12-18(13)17)15-8-4-3-5-9-15/h3-12H,1-2H3.
What are the key properties of 1,5-dimethyl-3-phenylnaphthalene?
1,5-dimethyl-3-phenylnaphthalene has a molecular weight of 232.33 g/mol, XLogP of 5.12, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-3-phenylnaphthalene is sourced from PubChem (CID 171720915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).