N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine

C34H23NO — CID 176844324

IUPACN,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine
SMILESc1ccc(-c2cc3ccccc3c3c2oc2cc(N(c4ccccc4)c4ccccc4)ccc23)cc1
InChIInChI=1S/C34H23NO/c1-4-12-24(13-5-1)31-22-25-14-10-11-19-29(25)33-30-21-20-28(23-32(30)36-34(31)33)35(26-15-6-2-7-16-26)27-17-8-3-9-18-27/h1-23H
InChIKeyNYISXLCDDTTZJT-UHFFFAOYSA-N
MW461.56 g/mol
LogP9.88
Rot. Bonds4

About N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine

N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine (PubChem CID 176844324) has the molecular formula C34H23NO and a molecular weight of 461.56 g/mol. Its IUPAC name is N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine.

Molecular Properties

Compound NameN,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine
PubChem CID176844324
Molecular FormulaC34H23NO
Molecular Weight461.56 g/mol
Exact Mass461.18
IUPAC NameN,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine
SMILESc1ccc(-c2cc3ccccc3c3c2oc2cc(N(c4ccccc4)c4ccccc4)ccc23)cc1
InChIInChI=1S/C34H23NO/c1-4-12-24(13-5-1)31-22-25-14-10-11-19-29(25)33-30-21-20-28(23-32(30)36-34(31)33)35(26-15-6-2-7-16-26)27-17-8-3-9-18-27/h1-23H
InChIKeyNYISXLCDDTTZJT-UHFFFAOYSA-N
XLogP9.88
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.56
LogP ≤ 59.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-phenyl-N,N-bis(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-9-amine
CID 176844541
N-(4-naphthalen-2-ylphenyl)-N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-3-phenylaniline
CID 170030961
N,4-diphenyl-N-[4-[9-(2-phenyl-1,3-benzoxazol-6-yl)naphtho[2,1-b][1]benzofuran-6-yl]phenyl]aniline
CID 171754733
N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-N-[4-(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 134337496
N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-4-phenyl-N-[4-(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]aniline
CID 134337497
N-(4-phenanthren-9-ylphenyl)-5-phenyl-N-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
CID 167143588
N,N-bis(4-phenylphenyl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-amine
CID 171433676
N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine
CID 176844569
N-phenyl-N-[4-(4-phenyldibenzofuran-1-yl)phenyl]phenanthren-2-amine
CID 176820436
5-N,18-N-di(phenanthren-2-yl)-5-N,18-N-diphenyl-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine
CID 121260434
3-(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)-N-[3-(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 88567931
9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran
CID 155128175

Frequently Asked Questions

What is the IUPAC name of N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine?
The IUPAC name of N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine (CID 176844324) is N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine.
What is the SMILES notation for N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine?
The canonical SMILES for N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine is c1ccc(-c2cc3ccccc3c3c2oc2cc(N(c4ccccc4)c4ccccc4)ccc23)cc1.
What is the InChIKey of N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine?
The InChIKey is NYISXLCDDTTZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23NO/c1-4-12-24(13-5-1)31-22-25-14-10-11-19-29(25)33-30-21-20-28(23-32(30)36-34(31)33)35(26-15-6-2-7-16-26)27-17-8-3-9-18-27/h1-23H.
What are the key properties of N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine?
N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine has a molecular weight of 461.56 g/mol, XLogP of 9.88, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine is sourced from PubChem (CID 176844324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).