N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine

C20H16FNO — CID 23593175

IUPACN-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine
SMILESCc1ccc2c(c1)oc1cc(N(C)c3ccc(F)cc3)ccc12
InChIInChI=1S/C20H16FNO/c1-13-3-9-17-18-10-8-16(12-20(18)23-19(17)11-13)22(2)15-6-4-14(21)5-7-15/h3-12H,1-2H3
InChIKeyYZXFCVUPOGKOCO-UHFFFAOYSA-N
MW305.35 g/mol
LogP5.80
Rot. Bonds2

About N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine

N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine (PubChem CID 23593175) has the molecular formula C20H16FNO and a molecular weight of 305.35 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine
PubChem CID23593175
Molecular FormulaC20H16FNO
Molecular Weight305.35 g/mol
Exact Mass305.12
IUPAC NameN-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine
SMILESCc1ccc2c(c1)oc1cc(N(C)c3ccc(F)cc3)ccc12
InChIInChI=1S/C20H16FNO/c1-13-3-9-17-18-10-8-16(12-20(18)23-19(17)11-13)22(2)15-6-4-14(21)5-7-15/h3-12H,1-2H3
InChIKeyYZXFCVUPOGKOCO-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

Acetamide, N-3-dibenzofuranyl-
CID 22087
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CID 71457198
4-(5-(125I)iodo-1-benzofuran-2-yl)-N,N-dimethyl(125I)aniline
CID 71462568
N-[4-(1-benzofuran-2-yl)phenyl]-2-(4-methylphenyl)acetamide
CID 153523840
N-Dibenzofuran-3-yl-3-methyl-butyramide
CID 2913552
N-(3-dibenzofuranyl)-2-methylpropanamide
CID 3150699
2,2,4-Trimethyl-1,2-dihydrobenzofuro[3,2-g]quinoline
CID 15458735
1,3,3-Trimethyl-3,4-dihydrobenzofuro[2,3-f]quinoline
CID 15458736
4-(2-(5-fluorobenzofuran-2-yl)vinyl)-N,N-dimethylbenzenamine
CID 44548163
N,N-dimethyl-4-(2-(6-methylbenzofuran-2-yl)vinyl)benzenamine
CID 44548166
4-(2-(6-fluorobenzofuran-2-yl)vinyl)-N,N-dimethylbenzenamine
CID 44548168

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine?
The IUPAC name of N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine (CID 23593175) is N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine.
What is the SMILES notation for N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine?
The canonical SMILES for N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine is Cc1ccc2c(c1)oc1cc(N(C)c3ccc(F)cc3)ccc12.
What is the InChIKey of N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine?
The InChIKey is YZXFCVUPOGKOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO/c1-13-3-9-17-18-10-8-16(12-20(18)23-19(17)11-13)22(2)15-6-4-14(21)5-7-15/h3-12H,1-2H3.
What are the key properties of N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine?
N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-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 N-(4-fluorophenyl)-N,7-dimethyldibenzofuran-3-amine is sourced from PubChem (CID 23593175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).