methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine

C146H104N6O3 — CID 165018255

IUPACmethane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine
SMILESC.C.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3ccc4c(c3)oc3ccccc34)c2)cc1.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3ccc4oc5ccccc5c4c3)c2)cc1.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3cccc4oc5ccccc5c34)c2)cc1
InChIInChI=1S/3C48H32N2O.2CH4/c1-3-14-33(15-4-1)35-16-11-19-38(32-35)49(44-25-13-27-46-47(44)42-21-8-10-26-45(42)51-46)37-30-28-34(29-31-37)39-22-12-23-41-40-20-7-9-24-43(40)50(48(39)41)36-17-5-2-6-18-36;1-3-13-33(14-4-1)35-15-11-18-38(31-35)49(39-29-30-43-42-20-8-10-24-46(42)51-47(43)32-39)37-27-25-34(26-28-37)40-21-12-22-44-41-19-7-9-23-45(41)50(48(40)44)36-16-5-2-6-17-36;1-3-13-33(14-4-1)35-15-11-18-38(31-35)49(39-29-30-47-44(32-39)42-20-8-10-24-46(42)51-47)37-27-25-34(26-28-37)40-21-12-22-43-41-19-7-9-23-45(41)50(48(40)43)36-16-5-2-6-17-36;;/h3*1-32H;2*1H4
InChIKeyKTODBQVNVJWDKC-UHFFFAOYSA-N
MW1990.48 g/mol
LogP41.73
Rot. Bonds18

About methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine

methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine (PubChem CID 165018255) has the molecular formula C146H104N6O3 and a molecular weight of 1990.48 g/mol. Its IUPAC name is methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine.

Molecular Properties

Compound Namemethane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine
PubChem CID165018255
Molecular FormulaC146H104N6O3
Molecular Weight1990.48 g/mol
Exact Mass1988.82
IUPAC Namemethane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine
SMILESC.C.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3ccc4c(c3)oc3ccccc34)c2)cc1.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3ccc4oc5ccccc5c4c3)c2)cc1.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3cccc4oc5ccccc5c34)c2)cc1
InChIInChI=1S/3C48H32N2O.2CH4/c1-3-14-33(15-4-1)35-16-11-19-38(32-35)49(44-25-13-27-46-47(44)42-21-8-10-26-45(42)51-46)37-30-28-34(29-31-37)39-22-12-23-41-40-20-7-9-24-43(40)50(48(39)41)36-17-5-2-6-18-36;1-3-13-33(14-4-1)35-15-11-18-38(31-35)49(39-29-30-43-42-20-8-10-24-46(42)51-47(43)32-39)37-27-25-34(26-28-37)40-21-12-22-44-41-19-7-9-23-45(41)50(48(40)44)36-16-5-2-6-17-36;1-3-13-33(14-4-1)35-15-11-18-38(31-35)49(39-29-30-47-44(32-39)42-20-8-10-24-46(42)51-47)37-27-25-34(26-28-37)40-21-12-22-43-41-19-7-9-23-45(41)50(48(40)43)36-16-5-2-6-17-36;;/h3*1-32H;2*1H4
InChIKeyKTODBQVNVJWDKC-UHFFFAOYSA-N
XLogP41.73
TPSA63.93 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms155
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001990.48
LogP ≤ 541.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine?
The IUPAC name of methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine (CID 165018255) is methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine.
What is the SMILES notation for methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine?
The canonical SMILES for methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine is C.C.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3ccc4c(c3)oc3ccccc34)c2)cc1.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3ccc4oc5ccccc5c4c3)c2)cc1.c1ccc(-c2cccc(N(c3ccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cc3)c3cccc4oc5ccccc5c34)c2)cc1.
What is the InChIKey of methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine?
The InChIKey is KTODBQVNVJWDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C48H32N2O.2CH4/c1-3-14-33(15-4-1)35-16-11-19-38(32-35)49(44-25-13-27-46-47(44)42-21-8-10-26-45(42)51-46)37-30-28-34(29-31-37)39-22-12-23-41-40-20-7-9-24-43(40)50(48(39)41)36-17-5-2-6-18-36;1-3-13-33(14-4-1)35-15-11-18-38(31-35)49(39-29-30-43-42-20-8-10-24-46(42)51-47(43)32-39)37-27-25-34(26-28-37)40-21-12-22-44-41-19-7-9-23-45(41)50(48(40)44)36-16-5-2-6-17-36;1-3-13-33(14-4-1)35-15-11-18-38(31-35)49(39-29-30-47-44(32-39)42-20-8-10-24-46(42)51-47)37-27-25-34(26-28-37)40-21-12-22-43-41-19-7-9-23-45(41)50(48(40)43)36-16-5-2-6-17-36;;/h3*1-32H;2*1H4.
What are the key properties of methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine?
methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine has a molecular weight of 1990.48 g/mol, XLogP of 41.73, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine is sourced from PubChem (CID 165018255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).