N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine

C24H19NO — CID 126701340

IUPACN-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine
SMILESCCN(c1ccccc1)c1cccc2c1ccc1c3ccccc3oc21
InChIInChI=1S/C24H19NO/c1-2-25(17-9-4-3-5-10-17)22-13-8-12-20-18(22)15-16-21-19-11-6-7-14-23(19)26-24(20)21/h3-16H,2H2,1H3
InChIKeyXXARCZUXCYCZTB-UHFFFAOYSA-N
MW337.42 g/mol
LogP6.90
Rot. Bonds3

About N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine

N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine (PubChem CID 126701340) has the molecular formula C24H19NO and a molecular weight of 337.42 g/mol. Its IUPAC name is N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine.

Molecular Properties

Compound NameN-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine
PubChem CID126701340
Molecular FormulaC24H19NO
Molecular Weight337.42 g/mol
Exact Mass337.15
IUPAC NameN-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine
SMILESCCN(c1ccccc1)c1cccc2c1ccc1c3ccccc3oc21
InChIInChI=1S/C24H19NO/c1-2-25(17-9-4-3-5-10-17)22-13-8-12-20-18(22)15-16-21-19-11-6-7-14-23(19)26-24(20)21/h3-16H,2H2,1H3
InChIKeyXXARCZUXCYCZTB-UHFFFAOYSA-N
XLogP6.90
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 56.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine?
The IUPAC name of N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine (CID 126701340) is N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine.
What is the SMILES notation for N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine?
The canonical SMILES for N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine is CCN(c1ccccc1)c1cccc2c1ccc1c3ccccc3oc21.
What is the InChIKey of N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine?
The InChIKey is XXARCZUXCYCZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO/c1-2-25(17-9-4-3-5-10-17)22-13-8-12-20-18(22)15-16-21-19-11-6-7-14-23(19)26-24(20)21/h3-16H,2H2,1H3.
What are the key properties of N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine?
N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine has a molecular weight of 337.42 g/mol, XLogP of 6.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenylnaphtho[1,2-b][1]benzofuran-4-amine is sourced from PubChem (CID 126701340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).