N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine

C40H27NO — CID 177130769

IUPACN,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine
SMILESc1ccc(-c2ccccc2N(c2ccccc2)c2ccc3c(ccc4oc5c(-c6ccccc6)cccc5c43)c2)cc1
InChIInChI=1S/C40H27NO/c1-4-13-28(14-5-1)33-19-10-11-22-37(33)41(31-17-8-3-9-18-31)32-24-25-34-30(27-32)23-26-38-39(34)36-21-12-20-35(40(36)42-38)29-15-6-2-7-16-29/h1-27H
InChIKeyRKCJQEQEFVZHFT-UHFFFAOYSA-N
MW537.66 g/mol
LogP11.54
Rot. Bonds5

About N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine

N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine (PubChem CID 177130769) has the molecular formula C40H27NO and a molecular weight of 537.66 g/mol. Its IUPAC name is N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine.

Molecular Properties

Compound NameN,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine
PubChem CID177130769
Molecular FormulaC40H27NO
Molecular Weight537.66 g/mol
Exact Mass537.21
IUPAC NameN,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine
SMILESc1ccc(-c2ccccc2N(c2ccccc2)c2ccc3c(ccc4oc5c(-c6ccccc6)cccc5c43)c2)cc1
InChIInChI=1S/C40H27NO/c1-4-13-28(14-5-1)33-19-10-11-22-37(33)41(31-17-8-3-9-18-31)32-24-25-34-30(27-32)23-26-38-39(34)36-21-12-20-35(40(36)42-38)29-15-6-2-7-16-29/h1-27H
InChIKeyRKCJQEQEFVZHFT-UHFFFAOYSA-N
XLogP11.54
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.66
LogP ≤ 511.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,8-diphenyl-N-(3-phenylphenyl)naphtho[2,1-b][1]benzofuran-2-amine
CID 177130948
N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-6-phenyl-N-(3-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-amine
CID 130289739
N,4-diphenyl-N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-8-amine
CID 177130990
6-N,18-N-bis(6-phenyldibenzofuran-4-yl)-6-N,18-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine
CID 90263358
8-N,9-N,9-N-triphenyl-8-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-8,9-diamine
CID 166856528
N,N-bis(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)naphtho[2,1-b][1]benzofuran-8-amine
CID 130289750
N-(4-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-7-phenyl-N-(2-phenylphenyl)naphthalen-2-amine
CID 170126954
N-[4-(5-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-2-amine
CID 170301157
N-(4-dibenzofuran-4-ylphenyl)-6-naphtho[2,1-b][1]benzofuran-3-yl-N-(4-phenylphenyl)naphthalen-1-amine
CID 170127531
N-[3-(8-phenylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-amine
CID 169285534
N-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-7-(6-phenyldibenzofuran-2-yl)phenanthren-2-amine
CID 168804799
5-N-dibenzofuran-3-yl-18-N-dibenzofuran-4-yl-5-N,18-N-bis(2-phenylphenyl)pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2(7),3,5,8,10,12,15(20),16,18,21-undecaene-5,18-diamine;5-N-dibenzofuran-3-yl-18-N-dibenzofuran-4-yl-5-N-phenyl-18-N-(2-phenylphenyl)pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2(7),3,5,8,10,12,15(20),16,18,21-undecaene-5,18-diamine
CID 160905734

Frequently Asked Questions

What is the IUPAC name of N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine?
The IUPAC name of N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine (CID 177130769) is N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine.
What is the SMILES notation for N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine?
The canonical SMILES for N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine is c1ccc(-c2ccccc2N(c2ccccc2)c2ccc3c(ccc4oc5c(-c6ccccc6)cccc5c43)c2)cc1.
What is the InChIKey of N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine?
The InChIKey is RKCJQEQEFVZHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27NO/c1-4-13-28(14-5-1)33-19-10-11-22-37(33)41(31-17-8-3-9-18-31)32-24-25-34-30(27-32)23-26-38-39(34)36-21-12-20-35(40(36)42-38)29-15-6-2-7-16-29/h1-27H.
What are the key properties of N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine?
N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine has a molecular weight of 537.66 g/mol, XLogP of 11.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,8-diphenyl-N-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine is sourced from PubChem (CID 177130769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).