2,3-dimethyl-1-naphthalen-1-ylnaphthalene

C22H18 — CID 54572329

IUPAC2,3-dimethyl-1-naphthalen-1-ylnaphthalene
SMILESCc1cc2ccccc2c(-c2cccc3ccccc23)c1C
InChIInChI=1S/C22H18/c1-15-14-18-9-4-6-12-20(18)22(16(15)2)21-13-7-10-17-8-3-5-11-19(17)21/h3-14H,1-2H3
InChIKeyZYESCHFPSVZSNA-UHFFFAOYSA-N
MW282.39 g/mol
LogP6.28
Rot. Bonds1

About 2,3-dimethyl-1-naphthalen-1-ylnaphthalene

2,3-dimethyl-1-naphthalen-1-ylnaphthalene (PubChem CID 54572329) has the molecular formula C22H18 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2,3-dimethyl-1-naphthalen-1-ylnaphthalene.

Molecular Properties

Compound Name2,3-dimethyl-1-naphthalen-1-ylnaphthalene
PubChem CID54572329
Molecular FormulaC22H18
Molecular Weight282.39 g/mol
Exact Mass282.14
IUPAC Name2,3-dimethyl-1-naphthalen-1-ylnaphthalene
SMILESCc1cc2ccccc2c(-c2cccc3ccccc23)c1C
InChIInChI=1S/C22H18/c1-15-14-18-9-4-6-12-20(18)22(16(15)2)21-13-7-10-17-8-3-5-11-19(17)21/h3-14H,1-2H3
InChIKeyZYESCHFPSVZSNA-UHFFFAOYSA-N
XLogP6.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.39
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-dimethyl-2-naphthalen-1-ylphenanthrene
CID 15440758
1,10-dinaphthalen-1-ylanthracene
CID 58645117
1,10-bis(2-methylnaphthalen-1-yl)anthracene
CID 123816307
1-(4-chlorophenyl)-2,3-dimethylnaphthalene
CID 123950118
2-[1-[2-(2-hydroxyphenyl)-3-methylnaphthalen-1-yl]-3-methylnaphthalen-2-yl]phenol
CID 4181148
6-methylbenzo[a]anthracene-7,12-dione
CID 12934886
3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol
CID 151645059
9-naphthalen-1-yl-10-(10-phenanthren-9-ylanthracen-9-yl)anthracene
CID 140825341
(10-naphthalen-1-ylanthracen-1-yl)boronic acid
CID 154381135
2-methyl-1-(3-methylnaphthalen-1-yl)naphthalene
CID 15148511
9-naphthalen-1-yl-10-[4-[4-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]naphthalen-1-yl]anthracene
CID 59861499
9-(2-methyl-3-phenanthren-9-ylphenyl)phenanthrene
CID 58099808

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-naphthalen-1-ylnaphthalene?
The IUPAC name of 2,3-dimethyl-1-naphthalen-1-ylnaphthalene (CID 54572329) is 2,3-dimethyl-1-naphthalen-1-ylnaphthalene.
What is the SMILES notation for 2,3-dimethyl-1-naphthalen-1-ylnaphthalene?
The canonical SMILES for 2,3-dimethyl-1-naphthalen-1-ylnaphthalene is Cc1cc2ccccc2c(-c2cccc3ccccc23)c1C.
What is the InChIKey of 2,3-dimethyl-1-naphthalen-1-ylnaphthalene?
The InChIKey is ZYESCHFPSVZSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18/c1-15-14-18-9-4-6-12-20(18)22(16(15)2)21-13-7-10-17-8-3-5-11-19(17)21/h3-14H,1-2H3.
What are the key properties of 2,3-dimethyl-1-naphthalen-1-ylnaphthalene?
2,3-dimethyl-1-naphthalen-1-ylnaphthalene has a molecular weight of 282.39 g/mol, XLogP of 6.28, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-naphthalen-1-ylnaphthalene is sourced from PubChem (CID 54572329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).