2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine

C42H31NO — CID 142406058

IUPAC2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine
SMILESC1=Cc2c(oc3cc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccccc4)c(-c4ccccc4)cc23)CC1
InChIInChI=1S/C42H31NO/c1-4-14-30(15-5-1)31-24-26-34(27-25-31)43(39-22-12-10-20-35(39)32-16-6-2-7-17-32)40-29-42-38(36-21-11-13-23-41(36)44-42)28-37(40)33-18-8-3-9-19-33/h1-12,14-22,24-29H,13,23H2
InChIKeyRXIUAVVNTCUWHH-UHFFFAOYSA-N
MW565.72 g/mol
LogP11.86
Rot. Bonds6

About 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine

2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine (PubChem CID 142406058) has the molecular formula C42H31NO and a molecular weight of 565.72 g/mol. Its IUPAC name is 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine.

Molecular Properties

Compound Name2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine
PubChem CID142406058
Molecular FormulaC42H31NO
Molecular Weight565.72 g/mol
Exact Mass565.24
IUPAC Name2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine
SMILESC1=Cc2c(oc3cc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccccc4)c(-c4ccccc4)cc23)CC1
InChIInChI=1S/C42H31NO/c1-4-14-30(15-5-1)31-24-26-34(27-25-31)43(39-22-12-10-20-35(39)32-16-6-2-7-17-32)40-29-42-38(36-21-11-13-23-41(36)44-42)28-37(40)33-18-8-3-9-19-33/h1-12,14-22,24-29H,13,23H2
InChIKeyRXIUAVVNTCUWHH-UHFFFAOYSA-N
XLogP11.86
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500565.72
LogP ≤ 511.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-diphenyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydrodibenzofuran-3-amine
CID 142406198
N,N-bis[2-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 121311269
N-(2-naphthalen-1-ylphenyl)-N-(4-phenanthren-9-ylphenyl)-6,7-dihydrodibenzofuran-4-amine
CID 166566529
N-[3-[9-(6,7-dihydrodibenzofuran-2-yl)carbazol-4-yl]phenyl]-N-(4-phenanthren-2-ylphenyl)-2-phenylaniline
CID 163703203
N-[4-(6,7-dihydrodibenzofuran-3-yl)phenyl]-3-(9,9-dimethylfluoren-3-yl)-N-phenylaniline
CID 156827193
7-N,17-N,17-N-tris(2-phenylphenyl)-7-N-(4-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine
CID 168753210
N-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 145390533
N-(6,7-dihydrodibenzofuran-3-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 131997661
N-[4-[3,5-bis[4-(2-phenyl-N-(2-phenylphenyl)anilino)phenyl]phenyl]phenyl]-2-phenyl-N-(2-phenylphenyl)aniline
CID 87182000
N-[4-(9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-6-yl)phenyl]-N,2-bis(4-phenylphenyl)aniline
CID 138651234
N-[2-(4a,11b-dihydronaphtho[1,2-b][1]benzofuran-8-yl)phenyl]-2-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 174273085
2-N,3-N-diphenyl-2-N,3-N-bis(2-phenylphenyl)naphtho[2,3-b][1]benzofuran-2,3-diamine
CID 166856649

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine?
The IUPAC name of 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine (CID 142406058) is 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine.
What is the SMILES notation for 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine?
The canonical SMILES for 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine is C1=Cc2c(oc3cc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccccc4)c(-c4ccccc4)cc23)CC1.
What is the InChIKey of 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine?
The InChIKey is RXIUAVVNTCUWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H31NO/c1-4-14-30(15-5-1)31-24-26-34(27-25-31)43(39-22-12-10-20-35(39)32-16-6-2-7-17-32)40-29-42-38(36-21-11-13-23-41(36)44-42)28-37(40)33-18-8-3-9-19-33/h1-12,14-22,24-29H,13,23H2.
What are the key properties of 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine?
2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine has a molecular weight of 565.72 g/mol, XLogP of 11.86, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-6,7-dihydrodibenzofuran-3-amine is sourced from PubChem (CID 142406058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).