N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine

C35H24N2O — CID 166861967

IUPACN-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccnc5c4oc4ccccc45)cc3)cc2)cc1
InChIInChI=1S/C35H24N2O/c1-3-9-25(10-4-1)26-15-17-27(18-16-26)28-19-21-30(22-20-28)37(29-11-5-2-6-12-29)32-23-24-36-34-31-13-7-8-14-33(31)38-35(32)34/h1-24H
InChIKeyVBWVZXIDUADSRQ-UHFFFAOYSA-N
MW488.59 g/mol
LogP9.78
Rot. Bonds5

About N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine

N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine (PubChem CID 166861967) has the molecular formula C35H24N2O and a molecular weight of 488.59 g/mol. Its IUPAC name is N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine.

Molecular Properties

Compound NameN-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine
PubChem CID166861967
Molecular FormulaC35H24N2O
Molecular Weight488.59 g/mol
Exact Mass488.19
IUPAC NameN-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccnc5c4oc4ccccc45)cc3)cc2)cc1
InChIInChI=1S/C35H24N2O/c1-3-9-25(10-4-1)26-15-17-27(18-16-26)28-19-21-30(22-20-28)37(29-11-5-2-6-12-29)32-23-24-36-34-31-13-7-8-14-33(31)38-35(32)34/h1-24H
InChIKeyVBWVZXIDUADSRQ-UHFFFAOYSA-N
XLogP9.78
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.59
LogP ≤ 59.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[3,2-b]pyridin-4-amine
CID 163825151
N-(4-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine
CID 166860859
N,N-bis(4-naphthalen-1-ylphenyl)-[1]benzofuro[3,2-b]pyridin-4-amine
CID 166861071
N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-6-amine
CID 166861996
N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-4-amine
CID 71126595
N-[4-([1]benzothiolo[3,2-b]pyridin-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 168738270
4-([1]benzofuro[3,2-b]pyridin-4-yl)-N,N-bis(4-triphenylen-1-ylphenyl)aniline
CID 168765389
N-dibenzofuran-4-yl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]dibenzofuran-4-amine
CID 71126744
N-(7-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-[1]benzofuro[3,2-b]pyridin-6-amine
CID 168738271
N-phenyl-N-(4-phenylphenyl)-[1]benzofuro[3,2-b]pyridin-9-amine
CID 168737884
N-[3-[4-[3-(N-dibenzofuran-4-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-4-amine
CID 71126918
N-phenyl-N-[4-(4-phenylphenyl)phenyl]-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-12-amine
CID 160898222

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine?
The IUPAC name of N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine (CID 166861967) is N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine.
What is the SMILES notation for N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine?
The canonical SMILES for N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccnc5c4oc4ccccc45)cc3)cc2)cc1.
What is the InChIKey of N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine?
The InChIKey is VBWVZXIDUADSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H24N2O/c1-3-9-25(10-4-1)26-15-17-27(18-16-26)28-19-21-30(22-20-28)37(29-11-5-2-6-12-29)32-23-24-36-34-31-13-7-8-14-33(31)38-35(32)34/h1-24H.
What are the key properties of N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine?
N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine has a molecular weight of 488.59 g/mol, XLogP of 9.78, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[4-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-amine is sourced from PubChem (CID 166861967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).