N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine

C32H21NO — CID 170272670

IUPACN-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)oc2cc4ccccc4cc23)c2cccc3ccccc23)cc1
InChIInChI=1S/C32H21NO/c1-2-13-25(14-3-1)33(30-16-8-12-22-9-6-7-15-27(22)30)26-17-18-28-29-19-23-10-4-5-11-24(23)20-31(29)34-32(28)21-26/h1-21H
InChIKeyKVLPMHFFDNXMOW-UHFFFAOYSA-N
MW435.53 g/mol
LogP9.36
Rot. Bonds3

About N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine

N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine (PubChem CID 170272670) has the molecular formula C32H21NO and a molecular weight of 435.53 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine
PubChem CID170272670
Molecular FormulaC32H21NO
Molecular Weight435.53 g/mol
Exact Mass435.16
IUPAC NameN-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)oc2cc4ccccc4cc23)c2cccc3ccccc23)cc1
InChIInChI=1S/C32H21NO/c1-2-13-25(14-3-1)33(30-16-8-12-22-9-6-7-15-27(22)30)26-17-18-28-29-19-23-10-4-5-11-24(23)20-31(29)34-32(28)21-26/h1-21H
InChIKeyKVLPMHFFDNXMOW-UHFFFAOYSA-N
XLogP9.36
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.53
LogP ≤ 59.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine?
The IUPAC name of N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine (CID 170272670) is N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine.
What is the SMILES notation for N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine?
The canonical SMILES for N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine is c1ccc(N(c2ccc3c(c2)oc2cc4ccccc4cc23)c2cccc3ccccc23)cc1.
What is the InChIKey of N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine?
The InChIKey is KVLPMHFFDNXMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21NO/c1-2-13-25(14-3-1)33(30-16-8-12-22-9-6-7-15-27(22)30)26-17-18-28-29-19-23-10-4-5-11-24(23)20-31(29)34-32(28)21-26/h1-21H.
What are the key properties of N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine?
N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine has a molecular weight of 435.53 g/mol, XLogP of 9.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-N-phenylnaphtho[2,3-b][1]benzofuran-3-amine is sourced from PubChem (CID 170272670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).