N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine

C31H27NO — CID 174329638

IUPACN-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine
SMILESc1ccc(-c2cc(Nc3ccc4c(c3)oc3ccccc34)ccc2C2CC3CCC2C3)cc1
InChIInChI=1S/C31H27NO/c1-2-6-21(7-3-1)29-18-23(12-14-25(29)28-17-20-10-11-22(28)16-20)32-24-13-15-27-26-8-4-5-9-30(26)33-31(27)19-24/h1-9,12-15,18-20,22,28,32H,10-11,16-17H2
InChIKeyIGJFBACPDDVSNO-UHFFFAOYSA-N
MW429.56 g/mol
LogP8.90
Rot. Bonds4

About N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine

N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine (PubChem CID 174329638) has the molecular formula C31H27NO and a molecular weight of 429.56 g/mol. Its IUPAC name is N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine.

Molecular Properties

Compound NameN-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine
PubChem CID174329638
Molecular FormulaC31H27NO
Molecular Weight429.56 g/mol
Exact Mass429.21
IUPAC NameN-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine
SMILESc1ccc(-c2cc(Nc3ccc4c(c3)oc3ccccc34)ccc2C2CC3CCC2C3)cc1
InChIInChI=1S/C31H27NO/c1-2-6-21(7-3-1)29-18-23(12-14-25(29)28-17-20-10-11-22(28)16-20)32-24-13-15-27-26-8-4-5-9-30(26)33-31(27)19-24/h1-9,12-15,18-20,22,28,32H,10-11,16-17H2
InChIKeyIGJFBACPDDVSNO-UHFFFAOYSA-N
XLogP8.90
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.56
LogP ≤ 58.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-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

N-[4-[4-[4-(N-[3-(2-bicyclo[2.2.1]heptanyl)phenyl]anilino)phenyl]-2,5-diphenylphenyl]phenyl]-N-phenyldibenzofuran-3-amine
CID 176611527
N-[4-(2-bicyclo[2.2.1]heptanyl)phenyl]-N-[4-(2,6-diphenylphenyl)phenyl]dibenzofuran-3-amine
CID 168771779
(1S,2S,4R)-2-(2-phenylphenyl)bicyclo[2.2.1]heptane
CID 16687687
N-[4-(2-bicyclo[2.2.1]heptanyl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 165165071
N,9-diphenyldibenzofuran-3-amine
CID 156790002
N-[4-(2-bicyclo[2.2.1]heptanyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 165165049
N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N-(4-phenylphenyl)dibenzofuran-3-amine;4-phenyl-N-(4-pyridin-3-ylphenyl)aniline
CID 162046042
N-dibenzofuran-2-yldibenzofuran-3-amine;ethane
CID 145077285
4-dibenzofuran-2-yl-N,3-bis(4-phenylphenyl)aniline
CID 164934515
2-[4-(2-bicyclo[2.2.1]heptanyl)phenyl]-4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 177112766
2,3-diphenyldibenzofuran
CID 12699263
2-dibenzofuran-3-yl-4-[3-[7-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,8'-tricyclo[5.3.1.04,9]undecane]-2-yl]phenyl]-6-phenyl-1,3,5-triazine
CID 167162782

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine?
The IUPAC name of N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine (CID 174329638) is N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine.
What is the SMILES notation for N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine?
The canonical SMILES for N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine is c1ccc(-c2cc(Nc3ccc4c(c3)oc3ccccc34)ccc2C2CC3CCC2C3)cc1.
What is the InChIKey of N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine?
The InChIKey is IGJFBACPDDVSNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H27NO/c1-2-6-21(7-3-1)29-18-23(12-14-25(29)28-17-20-10-11-22(28)16-20)32-24-13-15-27-26-8-4-5-9-30(26)33-31(27)19-24/h1-9,12-15,18-20,22,28,32H,10-11,16-17H2.
What are the key properties of N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine?
N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine has a molecular weight of 429.56 g/mol, XLogP of 8.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-bicyclo[2.2.1]heptanyl)-3-phenylphenyl]dibenzofuran-3-amine is sourced from PubChem (CID 174329638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).