(1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene

C26H22 — CID 143477898

IUPAC(1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene
SMILESCC1=Cc2cc3ccccc3c(-c3ccc4ccccc4c3)c2[C@H](C)C1
InChIInChI=1S/C26H22/c1-17-13-18(2)25-23(14-17)16-21-9-5-6-10-24(21)26(25)22-12-11-19-7-3-4-8-20(19)15-22/h3-12,14-16,18H,13H2,1-2H3/t18-/m1/s1
InChIKeyHCVHTLOYKFQHOI-GOSISDBHSA-N
MW334.46 g/mol
LogP7.57
Rot. Bonds1

About (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene

(1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene (PubChem CID 143477898) has the molecular formula C26H22 and a molecular weight of 334.46 g/mol. Its IUPAC name is (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene.

Molecular Properties

Compound Name(1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene
PubChem CID143477898
Molecular FormulaC26H22
Molecular Weight334.46 g/mol
Exact Mass334.17
IUPAC Name(1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene
SMILESCC1=Cc2cc3ccccc3c(-c3ccc4ccccc4c3)c2[C@H](C)C1
InChIInChI=1S/C26H22/c1-17-13-18(2)25-23(14-17)16-21-9-5-6-10-24(21)26(25)22-12-11-19-7-3-4-8-20(19)15-22/h3-12,14-16,18H,13H2,1-2H3/t18-/m1/s1
InChIKeyHCVHTLOYKFQHOI-GOSISDBHSA-N
XLogP7.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.46
LogP ≤ 57.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9-(7-naphthalen-2-ylnaphthalen-2-yl)anthracene
CID 86701353
ethane;9-naphthalen-2-yl-10-phenylanthracene
CID 91207825
9-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 21022512
9-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 58876197
9-(5-methyl-5,6-dihydronaphthalen-2-yl)-10-naphthalen-2-ylanthracene
CID 91435871
9-naphthalen-2-yl-10-[7-(10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]anthracene
CID 153438358
9-(4-naphthalen-2-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene
CID 123965396
9-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene
CID 59557532
2-methoxy-1-(2-methoxy-3-naphthalen-2-ylnaphthalen-1-yl)-3-naphthalen-2-ylnaphthalene
CID 10531028
9-naphthalen-2-yl-10-[4-[4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-1-yl]phenyl]anthracene
CID 59523734
4-(4-methyl-10-naphthalen-2-yl-3,4-dihydroanthracen-9-yl)cyclohexa-3,5-diene-1,2-diimine
CID 134321263
9-[4-(3,4-dihydronaphthalen-2-yl)phenyl]-10-naphthalen-2-ylanthracene
CID 123715814

Frequently Asked Questions

What is the IUPAC name of (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene?
The IUPAC name of (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene (CID 143477898) is (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene.
What is the SMILES notation for (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene?
The canonical SMILES for (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene is CC1=Cc2cc3ccccc3c(-c3ccc4ccccc4c3)c2[C@H](C)C1.
What is the InChIKey of (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene?
The InChIKey is HCVHTLOYKFQHOI-GOSISDBHSA-N. The full InChI is InChI=1S/C26H22/c1-17-13-18(2)25-23(14-17)16-21-9-5-6-10-24(21)26(25)22-12-11-19-7-3-4-8-20(19)15-22/h3-12,14-16,18H,13H2,1-2H3/t18-/m1/s1.
What are the key properties of (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene?
(1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene has a molecular weight of 334.46 g/mol, XLogP of 7.57, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1,3-dimethyl-9-naphthalen-2-yl-1,2-dihydroanthracene is sourced from PubChem (CID 143477898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).