4-dibenzofuran-2-yl-3-methylaniline

C19H15NO — CID 61025593

IUPAC4-dibenzofuran-2-yl-3-methylaniline
SMILESCc1cc(N)ccc1-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C19H15NO/c1-12-10-14(20)7-8-15(12)13-6-9-19-17(11-13)16-4-2-3-5-18(16)21-19/h2-11H,20H2,1H3
InChIKeyDDUDOZAXKUGGBE-UHFFFAOYSA-N
MW273.34 g/mol
LogP5.14
Rot. Bonds1

About 4-dibenzofuran-2-yl-3-methylaniline

4-dibenzofuran-2-yl-3-methylaniline (PubChem CID 61025593) has the molecular formula C19H15NO and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-dibenzofuran-2-yl-3-methylaniline.

Molecular Properties

Compound Name4-dibenzofuran-2-yl-3-methylaniline
PubChem CID61025593
Molecular FormulaC19H15NO
Molecular Weight273.34 g/mol
Exact Mass273.12
IUPAC Name4-dibenzofuran-2-yl-3-methylaniline
SMILESCc1cc(N)ccc1-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C19H15NO/c1-12-10-14(20)7-8-15(12)13-6-9-19-17(11-13)16-4-2-3-5-18(16)21-19/h2-11H,20H2,1H3
InChIKeyDDUDOZAXKUGGBE-UHFFFAOYSA-N
XLogP5.14
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.34
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(2-methylphenyl)dibenzofuran
CID 118188503
dibenzofuran-2-amine
CID 19405
2-[4-(4-methylnaphthalen-1-yl)phenyl]dibenzofuran
CID 67964760
1-methyl-8-(2-methyldibenzofuran-3-yl)dibenzofuran
CID 175613523
4-(2-ethyl-1-benzofuran-3-yl)-3-methylaniline
CID 62956805
8-(5-amino-2-carbazol-9-ylphenyl)dibenzofuran-2-amine
CID 126596844
2-(5-dibenzofuran-2-ylbenzo[c]phenanthren-8-yl)dibenzofuran
CID 59282074
2-(16-dibenzofuran-2-yl-5-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14(19),15,17,21,23,25,27,29,31,33,35-octadecaenyl)dibenzofuran
CID 134428938
N-(3-methyl-4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 138488713
9-(4-amino-2-methylphenyl)xanthen-3-one
CID 143374251
8-fluoranthen-3-yl-1-methyldibenzofuran
CID 145447322
2-[3-dibenzofuran-2-yl-5-[7-[3,5-di(dibenzofuran-2-yl)phenyl]triphenylen-2-yl]phenyl]dibenzofuran
CID 118490746

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-2-yl-3-methylaniline?
The IUPAC name of 4-dibenzofuran-2-yl-3-methylaniline (CID 61025593) is 4-dibenzofuran-2-yl-3-methylaniline.
What is the SMILES notation for 4-dibenzofuran-2-yl-3-methylaniline?
The canonical SMILES for 4-dibenzofuran-2-yl-3-methylaniline is Cc1cc(N)ccc1-c1ccc2oc3ccccc3c2c1.
What is the InChIKey of 4-dibenzofuran-2-yl-3-methylaniline?
The InChIKey is DDUDOZAXKUGGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c1-12-10-14(20)7-8-15(12)13-6-9-19-17(11-13)16-4-2-3-5-18(16)21-19/h2-11H,20H2,1H3.
What are the key properties of 4-dibenzofuran-2-yl-3-methylaniline?
4-dibenzofuran-2-yl-3-methylaniline has a molecular weight of 273.34 g/mol, XLogP of 5.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-2-yl-3-methylaniline is sourced from PubChem (CID 61025593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).