N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine

C40H27NO — CID 170675174

IUPACN,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
SMILESc1ccc(-c2ccc(Nc3ccc4c(oc5c6ccccc6ccc45)c3-c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C40H27NO/c1-3-9-27(10-4-1)29-15-17-32(18-16-29)38-37(41-33-22-19-30(20-23-33)28-11-5-2-6-12-28)26-25-36-35-24-21-31-13-7-8-14-34(31)39(35)42-40(36)38/h1-26,41H
InChIKeyZMKGHVSIJAZLDW-UHFFFAOYSA-N
MW537.66 g/mol
LogP11.48
Rot. Bonds5

About N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine

N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine (PubChem CID 170675174) has the molecular formula C40H27NO and a molecular weight of 537.66 g/mol. Its IUPAC name is N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine.

Molecular Properties

Compound NameN,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
PubChem CID170675174
Molecular FormulaC40H27NO
Molecular Weight537.66 g/mol
Exact Mass537.21
IUPAC NameN,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
SMILESc1ccc(-c2ccc(Nc3ccc4c(oc5c6ccccc6ccc45)c3-c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C40H27NO/c1-3-9-27(10-4-1)29-15-17-32(18-16-29)38-37(41-33-22-19-30(20-23-33)28-11-5-2-6-12-28)26-25-36-35-24-21-31-13-7-8-14-34(31)39(35)42-40(36)38/h1-26,41H
InChIKeyZMKGHVSIJAZLDW-UHFFFAOYSA-N
XLogP11.48
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.66
LogP ≤ 511.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diphenyl-10-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
CID 170675548
4-[(1-phenylnaphthalen-2-yl)amino]phenol
CID 67541341
N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59029878
7-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14,16,18,20-decaene
CID 130188697
10-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 171421116
6-phenyl-24-oxahexacyclo[11.11.0.02,10.03,8.014,23.017,22]tetracosa-1(13),2(10),3(8),4,6,11,14(23),15,17,19,21-undecaene
CID 162217448
N-phenanthren-2-yl-6-phenyldibenzofuran-4-amine
CID 118027817
N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 58672315
N-[4-(9,9-dimethylfluoren-1-yl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 177121842
N-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran-10-amine
CID 168804074
N,9-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 170675430
N-(4-anthracen-9-ylphenyl)-4-phenylaniline
CID 134240819

Frequently Asked Questions

What is the IUPAC name of N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine?
The IUPAC name of N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine (CID 170675174) is N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine.
What is the SMILES notation for N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine?
The canonical SMILES for N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine is c1ccc(-c2ccc(Nc3ccc4c(oc5c6ccccc6ccc45)c3-c3ccc(-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine?
The InChIKey is ZMKGHVSIJAZLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27NO/c1-3-9-27(10-4-1)29-15-17-32(18-16-29)38-37(41-33-22-19-30(20-23-33)28-11-5-2-6-12-28)26-25-36-35-24-21-31-13-7-8-14-34(31)39(35)42-40(36)38/h1-26,41H.
What are the key properties of N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine?
N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine has a molecular weight of 537.66 g/mol, XLogP of 11.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,10-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine is sourced from PubChem (CID 170675174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).