3-methyl-2-naphthalen-2-yl-1-benzofuran

C19H14O — CID 54024232

IUPAC3-methyl-2-naphthalen-2-yl-1-benzofuran
SMILESCc1c(-c2ccc3ccccc3c2)oc2ccccc12
InChIInChI=1S/C19H14O/c1-13-17-8-4-5-9-18(17)20-19(13)16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3
InChIKeyLBAVLWLJIPVZSK-UHFFFAOYSA-N
MW258.32 g/mol
LogP5.56
Rot. Bonds1

About 3-methyl-2-naphthalen-2-yl-1-benzofuran

3-methyl-2-naphthalen-2-yl-1-benzofuran (PubChem CID 54024232) has the molecular formula C19H14O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-methyl-2-naphthalen-2-yl-1-benzofuran.

Molecular Properties

Compound Name3-methyl-2-naphthalen-2-yl-1-benzofuran
PubChem CID54024232
Molecular FormulaC19H14O
Molecular Weight258.32 g/mol
Exact Mass258.10
IUPAC Name3-methyl-2-naphthalen-2-yl-1-benzofuran
SMILESCc1c(-c2ccc3ccccc3c2)oc2ccccc12
InChIInChI=1S/C19H14O/c1-13-17-8-4-5-9-18(17)20-19(13)16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3
InChIKeyLBAVLWLJIPVZSK-UHFFFAOYSA-N
XLogP5.56
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.32
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-methyl-1-benzofuran-2-yl)-N-(4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)aniline
CID 170526059
N-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 170399243
N-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]naphthalen-2-amine
CID 170399249
N-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]-N-naphthalen-2-ylphenanthren-9-amine
CID 170399244
3-(3-methyl-1-benzofuran-2-yl)-N-(4-phenanthren-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 170400365
3-hydroxy-2-naphthalen-2-ylchromen-4-one
CID 10085495
N-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]-N-[2-(4-phenylphenyl)phenyl]naphthalen-2-amine
CID 170399246
3-(3-methyl-1-benzofuran-2-yl)-6-naphthalen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
CID 91963032
N-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]-N-(4-phenanthren-2-ylphenyl)-3-phenylaniline
CID 170399413
4-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]-N-(4-phenanthren-2-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 170401432
3-naphthalen-2-yldibenzofuran
CID 68932481
N-[4-[4-[3-(3-methyl-1-benzofuran-2-yl)phenyl]phenyl]phenyl]-4-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 170401544

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-naphthalen-2-yl-1-benzofuran?
The IUPAC name of 3-methyl-2-naphthalen-2-yl-1-benzofuran (CID 54024232) is 3-methyl-2-naphthalen-2-yl-1-benzofuran.
What is the SMILES notation for 3-methyl-2-naphthalen-2-yl-1-benzofuran?
The canonical SMILES for 3-methyl-2-naphthalen-2-yl-1-benzofuran is Cc1c(-c2ccc3ccccc3c2)oc2ccccc12.
What is the InChIKey of 3-methyl-2-naphthalen-2-yl-1-benzofuran?
The InChIKey is LBAVLWLJIPVZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O/c1-13-17-8-4-5-9-18(17)20-19(13)16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3.
What are the key properties of 3-methyl-2-naphthalen-2-yl-1-benzofuran?
3-methyl-2-naphthalen-2-yl-1-benzofuran has a molecular weight of 258.32 g/mol, XLogP of 5.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-naphthalen-2-yl-1-benzofuran is sourced from PubChem (CID 54024232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).