2-(2-methylpropyl)dibenzofuran

C16H16O — CID 59877560

IUPAC2-(2-methylpropyl)dibenzofuran
SMILESCC(C)Cc1ccc2oc3ccccc3c2c1
InChIInChI=1S/C16H16O/c1-11(2)9-12-7-8-16-14(10-12)13-5-3-4-6-15(13)17-16/h3-8,10-11H,9H2,1-2H3
InChIKeyIURAAGJQHBNKQS-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.78
Rot. Bonds2

About 2-(2-methylpropyl)dibenzofuran

2-(2-methylpropyl)dibenzofuran (PubChem CID 59877560) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(2-methylpropyl)dibenzofuran.

Molecular Properties

Compound Name2-(2-methylpropyl)dibenzofuran
PubChem CID59877560
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name2-(2-methylpropyl)dibenzofuran
SMILESCC(C)Cc1ccc2oc3ccccc3c2c1
InChIInChI=1S/C16H16O/c1-11(2)9-12-7-8-16-14(10-12)13-5-3-4-6-15(13)17-16/h3-8,10-11H,9H2,1-2H3
InChIKeyIURAAGJQHBNKQS-UHFFFAOYSA-N
XLogP4.78
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-dibenzofuran-2-ylpropan-2-amine
CID 42647881
4-bromo-2-(2-methylpropyl)dibenzofuran
CID 166913108
2-dibenzofuran-2-ylethanol
CID 567048
N-(dibenzofuran-2-ylmethyl)propan-1-amine
CID 19048253
2-[3-[6,10-bis(3-dibenzofuran-2-ylpropyl)triphenylen-2-yl]propyl]dibenzofuran
CID 59412017
5-dibenzofuran-2-yl-N,3-dimethylpentan-1-amine
CID 65304674
1-dibenzofuran-2-yl-3-methylbutan-1-amine
CID 43100935
3-dibenzofuran-2-ylpropan-1-amine chloride
CID 5351909
1-dibenzofuran-2-yl-3-methylbutan-1-one
CID 43160223
10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4,6,8,11,14,16,18-nonaene;ethane
CID 154692122
2-[(1S)-1-chloroethyl]dibenzofuran
CID 129370090
1-dibenzofuran-2-ylethanamine;hydrochloride
CID 13012128

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)dibenzofuran?
The IUPAC name of 2-(2-methylpropyl)dibenzofuran (CID 59877560) is 2-(2-methylpropyl)dibenzofuran.
What is the SMILES notation for 2-(2-methylpropyl)dibenzofuran?
The canonical SMILES for 2-(2-methylpropyl)dibenzofuran is CC(C)Cc1ccc2oc3ccccc3c2c1.
What is the InChIKey of 2-(2-methylpropyl)dibenzofuran?
The InChIKey is IURAAGJQHBNKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-11(2)9-12-7-8-16-14(10-12)13-5-3-4-6-15(13)17-16/h3-8,10-11H,9H2,1-2H3.
What are the key properties of 2-(2-methylpropyl)dibenzofuran?
2-(2-methylpropyl)dibenzofuran has a molecular weight of 224.30 g/mol, XLogP of 4.78, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)dibenzofuran is sourced from PubChem (CID 59877560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).