6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine

C21H18FNO — CID 138652786

IUPAC6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
SMILESCCc1cccc2c1oc1c(N(C)c3ccccc3F)cccc12
InChIInChI=1S/C21H18FNO/c1-3-14-8-6-9-15-16-10-7-13-19(21(16)24-20(14)15)23(2)18-12-5-4-11-17(18)22/h4-13H,3H2,1-2H3
InChIKeyUSCGFESNIFBCEA-UHFFFAOYSA-N
MW319.38 g/mol
LogP6.06
Rot. Bonds3

About 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine

6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine (PubChem CID 138652786) has the molecular formula C21H18FNO and a molecular weight of 319.38 g/mol. Its IUPAC name is 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine.

Molecular Properties

Compound Name6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
PubChem CID138652786
Molecular FormulaC21H18FNO
Molecular Weight319.38 g/mol
Exact Mass319.14
IUPAC Name6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
SMILESCCc1cccc2c1oc1c(N(C)c3ccccc3F)cccc12
InChIInChI=1S/C21H18FNO/c1-3-14-8-6-9-15-16-10-7-13-19(21(16)24-20(14)15)23(2)18-12-5-4-11-17(18)22/h4-13H,3H2,1-2H3
InChIKeyUSCGFESNIFBCEA-UHFFFAOYSA-N
XLogP6.06
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.38
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylphenyl)-6-fluoro-N-methyldibenzofuran-4-amine
CID 134527957
N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527943
N-(2-ethylphenyl)-N-methyl-6-(trifluoromethyl)dibenzofuran-4-amine
CID 134527991
6-tert-butyl-N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine
CID 134527976
N-(2-ethylphenyl)-N-methyl-6-propan-2-yldibenzofuran-4-amine
CID 138651496
6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine
CID 134527955
6-cyclohexyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527994
6-fluoro-N-methyl-N-[2-(trifluoromethoxy)phenyl]dibenzofuran-4-amine
CID 134527961
N-(2-ethylphenyl)-6-fluoro-N-methyl-8,9-dihydrodibenzofuran-4-amine
CID 145276740
9-N,24-N-bis(6-ethyldibenzofuran-4-yl)-9-N,24-N-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-9,24-diamine
CID 138745154
N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 138456773
4-ethylxanthen-9-one
CID 15075530

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine?
The IUPAC name of 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine (CID 138652786) is 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine.
What is the SMILES notation for 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine?
The canonical SMILES for 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine is CCc1cccc2c1oc1c(N(C)c3ccccc3F)cccc12.
What is the InChIKey of 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine?
The InChIKey is USCGFESNIFBCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FNO/c1-3-14-8-6-9-15-16-10-7-13-19(21(16)24-20(14)15)23(2)18-12-5-4-11-17(18)22/h4-13H,3H2,1-2H3.
What are the key properties of 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine?
6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine has a molecular weight of 319.38 g/mol, XLogP of 6.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine is sourced from PubChem (CID 138652786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).