N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine

C23H14F3NO — CID 126550573

IUPACN-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine
SMILESFC(F)(F)c1ccc(Nc2cccc3c2oc2ccc4ccccc4c23)cc1
InChIInChI=1S/C23H14F3NO/c24-23(25,26)15-9-11-16(12-10-15)27-19-7-3-6-18-21-17-5-2-1-4-14(17)8-13-20(21)28-22(18)19/h1-13,27H
InChIKeyMHYXWWFSXBPDGU-UHFFFAOYSA-N
MW377.37 g/mol
LogP7.50
Rot. Bonds2

About N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine

N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine (PubChem CID 126550573) has the molecular formula C23H14F3NO and a molecular weight of 377.37 g/mol. Its IUPAC name is N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine.

Molecular Properties

Compound NameN-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine
PubChem CID126550573
Molecular FormulaC23H14F3NO
Molecular Weight377.37 g/mol
Exact Mass377.10
IUPAC NameN-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine
SMILESFC(F)(F)c1ccc(Nc2cccc3c2oc2ccc4ccccc4c23)cc1
InChIInChI=1S/C23H14F3NO/c24-23(25,26)15-9-11-16(12-10-15)27-19-7-3-6-18-21-17-5-2-1-4-14(17)8-13-20(21)28-22(18)19/h1-13,27H
InChIKeyMHYXWWFSXBPDGU-UHFFFAOYSA-N
XLogP7.50
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.37
LogP ≤ 57.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-2-yl)naphtho[2,1-b][1]benzofuran-8-amine
CID 171730668
N-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran-10-amine
CID 168804074
N-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]dibenzofuran-4-amine
CID 177114269
N-[4-(4-naphthalen-2-ylphenyl)phenyl]dibenzofuran-4-amine
CID 172544746
N-[4-[4-(dibenzofuran-4-ylamino)phenyl]phenyl]dibenzofuran-4-amine
CID 172539034
2-(trifluoromethyl)benzo[c]phenanthrene
CID 44623566
N-(4-methylphenyl)phenanthren-4-amine
CID 122607190
N-[4-(trinaphthalen-1-ylmethyl)phenyl]naphthalen-1-amine
CID 154127820
6-(2-methylpropyl)-N-phenylnaphtho[2,1-b][1]benzofuran-8-amine
CID 146579665
N-(4-methylphenyl)-6-phenylnaphtho[2,1-b][1]benzofuran-8-amine
CID 126561028
N-phenanthren-2-yl-6-phenyldibenzofuran-4-amine
CID 118027817
N-[4-(2-phenylpropan-2-yl)phenyl]naphthalen-1-amine
CID 18331969

Frequently Asked Questions

What is the IUPAC name of N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine?
The IUPAC name of N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine (CID 126550573) is N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine.
What is the SMILES notation for N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine?
The canonical SMILES for N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine is FC(F)(F)c1ccc(Nc2cccc3c2oc2ccc4ccccc4c23)cc1.
What is the InChIKey of N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine?
The InChIKey is MHYXWWFSXBPDGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14F3NO/c24-23(25,26)15-9-11-16(12-10-15)27-19-7-3-6-18-21-17-5-2-1-4-14(17)8-13-20(21)28-22(18)19/h1-13,27H.
What are the key properties of N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine?
N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine has a molecular weight of 377.37 g/mol, XLogP of 7.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran-8-amine is sourced from PubChem (CID 126550573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).