N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine

C25H19NO — CID 121356816

IUPACN-(3-methylphenyl)-3-phenyldibenzofuran-2-amine
SMILESCc1cccc(Nc2cc3c(cc2-c2ccccc2)oc2ccccc23)c1
InChIInChI=1S/C25H19NO/c1-17-8-7-11-19(14-17)26-23-15-22-20-12-5-6-13-24(20)27-25(22)16-21(23)18-9-3-2-4-10-18/h2-16,26H,1H3
InChIKeyZAFGNCGJTQRMQH-UHFFFAOYSA-N
MW349.43 g/mol
LogP7.31
Rot. Bonds3

About N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine

N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine (PubChem CID 121356816) has the molecular formula C25H19NO and a molecular weight of 349.43 g/mol. Its IUPAC name is N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine.

Molecular Properties

Compound NameN-(3-methylphenyl)-3-phenyldibenzofuran-2-amine
PubChem CID121356816
Molecular FormulaC25H19NO
Molecular Weight349.43 g/mol
Exact Mass349.15
IUPAC NameN-(3-methylphenyl)-3-phenyldibenzofuran-2-amine
SMILESCc1cccc(Nc2cc3c(cc2-c2ccccc2)oc2ccccc23)c1
InChIInChI=1S/C25H19NO/c1-17-8-7-11-19(14-17)26-23-15-22-20-12-5-6-13-24(20)27-25(22)16-21(23)18-9-3-2-4-10-18/h2-16,26H,1H3
InChIKeyZAFGNCGJTQRMQH-UHFFFAOYSA-N
XLogP7.31
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.43
LogP ≤ 57.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-dibenzofuran-2-ylphenyl)-2-phenylaniline
CID 121360316
2,3-diphenyldibenzofuran
CID 12699263
2-[4-[3-(2-anilinophenyl)phenyl]phenyl]-N-(3-dibenzofuran-3-ylphenyl)aniline
CID 118534074
3-(3-methylphenyl)dibenzofuran
CID 70924364
2-N,8-N-bis(2-phenylphenyl)dibenzofuran-2,8-diamine
CID 141309629
N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 163590855
1,1'-biphenyl;3-methyl-N-phenylaniline
CID 19838437
N-[3-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-1-amine
CID 170108986
N-[4-[(1S)-1-amino-2-(2-aminophenyl)-2-phenylethyl]phenyl]-3-phenyldibenzofuran-2-amine
CID 118534379
3-[2-[3-[(3-phenyldibenzofuran-2-yl)amino]phenyl]-1,4-dihydroquinazolin-4-yl]benzonitrile
CID 118534237
5-(9-dibenzofuran-2-ylcarbazol-3-yl)-N,2-diphenylaniline
CID 118534077
N-(3-dibenzofuran-1-ylphenyl)-2-(8-phenylnaphthalen-1-yl)aniline
CID 170298496

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine?
The IUPAC name of N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine (CID 121356816) is N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine.
What is the SMILES notation for N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine?
The canonical SMILES for N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine is Cc1cccc(Nc2cc3c(cc2-c2ccccc2)oc2ccccc23)c1.
What is the InChIKey of N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine?
The InChIKey is ZAFGNCGJTQRMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19NO/c1-17-8-7-11-19(14-17)26-23-15-22-20-12-5-6-13-24(20)27-25(22)16-21(23)18-9-3-2-4-10-18/h2-16,26H,1H3.
What are the key properties of N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine?
N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine has a molecular weight of 349.43 g/mol, XLogP of 7.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-3-phenyldibenzofuran-2-amine is sourced from PubChem (CID 121356816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).