6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine

C20H16FNO — CID 134527955

IUPAC6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine
SMILESCc1ccccc1N(C)c1cccc2c1oc1c(F)cccc12
InChIInChI=1S/C20H16FNO/c1-13-7-3-4-11-17(13)22(2)18-12-6-9-15-14-8-5-10-16(21)19(14)23-20(15)18/h3-12H,1-2H3
InChIKeyLXOXFKOAEIHVAP-UHFFFAOYSA-N
MW305.35 g/mol
LogP5.80
Rot. Bonds2

About 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine

6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine (PubChem CID 134527955) has the molecular formula C20H16FNO and a molecular weight of 305.35 g/mol. Its IUPAC name is 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound Name6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine
PubChem CID134527955
Molecular FormulaC20H16FNO
Molecular Weight305.35 g/mol
Exact Mass305.12
IUPAC Name6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine
SMILESCc1ccccc1N(C)c1cccc2c1oc1c(F)cccc12
InChIInChI=1S/C20H16FNO/c1-13-7-3-4-11-17(13)22(2)18-12-6-9-15-14-8-5-10-16(21)19(14)23-20(15)18/h3-12H,1-2H3
InChIKeyLXOXFKOAEIHVAP-UHFFFAOYSA-N
XLogP5.80
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.35
LogP ≤ 55.80
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
6-fluoro-N-methyl-N-[2-(trifluoromethoxy)phenyl]dibenzofuran-4-amine
CID 134527961
N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527943
6-ethyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 138652786
6-cyclohexyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527994
N-(2,4-dimethylphenyl)-6-fluoro-N-iododibenzofuran-4-amine
CID 137417021
2-(bromomethyl)-3-fluoro-N-methyl-N-(2-methylphenyl)aniline
CID 114065440
N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 138456773
4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine
CID 90263201
N-(2-ethylphenyl)-N-methyl-6-(trifluoromethyl)dibenzofuran-4-amine
CID 134527991
N-methyl-N-[2-(trifluoromethoxy)phenyl]-6-(trifluoromethyl)dibenzofuran-4-amine
CID 134527993
6-[N-methyl-2-(trifluoromethyl)anilino]dibenzofuran-4-carbonitrile
CID 134527975

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine?
The IUPAC name of 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine (CID 134527955) is 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine?
The canonical SMILES for 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine is Cc1ccccc1N(C)c1cccc2c1oc1c(F)cccc12.
What is the InChIKey of 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine?
The InChIKey is LXOXFKOAEIHVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO/c1-13-7-3-4-11-17(13)22(2)18-12-6-9-15-14-8-5-10-16(21)19(14)23-20(15)18/h3-12H,1-2H3.
What are the key properties of 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine?
6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine has a molecular weight of 305.35 g/mol, XLogP of 5.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 134527955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).