N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine

C161H136FN7O5S2 — CID 159407129

IUPACN-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
SMILESCC(C)c1ccccc1N(C)c1cccc2c1oc1ccccc12.CCc1ccccc1N(C)c1cccc2c1oc1ccccc12.CN(c1ccc(-c2ccccc2)cc1-c1ccccc1)c1cccc2c1sc1ccccc12.CN(c1cccc(-c2ccccc2)c1)c1cccc2c1sc1ccccc12.CN(c1ccccc1C(C)(C)C)c1cccc2c1oc1ccccc12.CN(c1ccccc1F)c1cccc2c1oc1ccccc12.Cc1ccccc1N(C)c1cccc2c1oc1ccccc12
InChIInChI=1S/C31H23NS.C25H19NS.C23H23NO.C22H21NO.C21H19NO.C20H17NO.C19H14FNO/c1-32(29-17-10-16-26-25-15-8-9-18-30(25)33-31(26)29)28-20-19-24(22-11-4-2-5-12-22)21-27(28)23-13-6-3-7-14-23;1-26(20-12-7-11-19(17-20)18-9-3-2-4-10-18)23-15-8-14-22-21-13-5-6-16-24(21)27-25(22)23;1-23(2,3)18-12-6-7-13-19(18)24(4)20-14-9-11-17-16-10-5-8-15-21(16)25-22(17)20;1-15(2)16-9-4-6-12-19(16)23(3)20-13-8-11-18-17-10-5-7-14-21(17)24-22(18)20;1-3-15-9-4-6-12-18(15)22(2)19-13-8-11-17-16-10-5-7-14-20(16)23-21(17)19;1-14-8-3-5-11-17(14)21(2)18-12-7-10-16-15-9-4-6-13-19(15)22-20(16)18;1-21(16-10-4-3-9-15(16)20)17-11-6-8-14-13-7-2-5-12-18(13)22-19(14)17/h2-21H,1H3;2-17H,1H3;5-15H,1-4H3;4-15H,1-3H3;4-14H,3H2,1-2H3;3-13H,1-2H3;2-12H,1H3
InChIKeyLOCIAZJVWDTWTQ-UHFFFAOYSA-N
MW2332.03 g/mol
LogP46.85
Rot. Bonds19

About N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine

N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine (PubChem CID 159407129) has the molecular formula C161H136FN7O5S2 and a molecular weight of 2332.03 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
PubChem CID159407129
Molecular FormulaC161H136FN7O5S2
Molecular Weight2332.03 g/mol
Exact Mass2330.00
IUPAC NameN-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
SMILESCC(C)c1ccccc1N(C)c1cccc2c1oc1ccccc12.CCc1ccccc1N(C)c1cccc2c1oc1ccccc12.CN(c1ccc(-c2ccccc2)cc1-c1ccccc1)c1cccc2c1sc1ccccc12.CN(c1cccc(-c2ccccc2)c1)c1cccc2c1sc1ccccc12.CN(c1ccccc1C(C)(C)C)c1cccc2c1oc1ccccc12.CN(c1ccccc1F)c1cccc2c1oc1ccccc12.Cc1ccccc1N(C)c1cccc2c1oc1ccccc12
InChIInChI=1S/C31H23NS.C25H19NS.C23H23NO.C22H21NO.C21H19NO.C20H17NO.C19H14FNO/c1-32(29-17-10-16-26-25-15-8-9-18-30(25)33-31(26)29)28-20-19-24(22-11-4-2-5-12-22)21-27(28)23-13-6-3-7-14-23;1-26(20-12-7-11-19(17-20)18-9-3-2-4-10-18)23-15-8-14-22-21-13-5-6-16-24(21)27-25(22)23;1-23(2,3)18-12-6-7-13-19(18)24(4)20-14-9-11-17-16-10-5-8-15-21(16)25-22(17)20;1-15(2)16-9-4-6-12-19(16)23(3)20-13-8-11-18-17-10-5-7-14-21(17)24-22(18)20;1-3-15-9-4-6-12-18(15)22(2)19-13-8-11-17-16-10-5-7-14-20(16)23-21(17)19;1-14-8-3-5-11-17(14)21(2)18-12-7-10-16-15-9-4-6-13-19(15)22-20(16)18;1-21(16-10-4-3-9-15(16)20)17-11-6-8-14-13-7-2-5-12-18(13)22-19(14)17/h2-21H,1H3;2-17H,1H3;5-15H,1-4H3;4-15H,1-3H3;4-14H,3H2,1-2H3;3-13H,1-2H3;2-12H,1H3
InChIKeyLOCIAZJVWDTWTQ-UHFFFAOYSA-N
XLogP46.85
TPSA88.38 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds19
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002332.03
LogP ≤ 546.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine with MolForge

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Related Compounds

N-(2,4-diphenylphenyl)-N-methyldibenzofuran-4-amine
CID 134527925
N-[3-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)phenyl]phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine
CID 177084663
N-[4-(2-phenyldibenzofuran-4-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine
CID 140919317
N-[3-[4-(3-oxa-20-thiapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4,6,8,10,12,14,16,18-nonaen-11-yl)phenyl]phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine
CID 177084667
N-(6-tert-butyldibenzothiophen-1-yl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 163507001
N-dibenzothiophen-4-yl-N-[4-(2-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 163662266
1-N,6-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methyl-5-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 163594288
1-N,6-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;6-N-dibenzofuran-4-yl-1-N-(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methyl-5-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 161114249
N-dibenzothiophen-4-yl-3-phenyl-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 171435470
6-tert-butyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
CID 134527978
N-(2-ethylphenyl)-N-methyl-6-propan-2-yldibenzofuran-4-amine
CID 138651496
N-dibenzothiophen-4-yl-N-[4-(5-phenylnaphthalen-2-yl)phenyl]dibenzofuran-4-amine
CID 154605617

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
The IUPAC name of N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine (CID 159407129) is N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
The canonical SMILES for N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine is CC(C)c1ccccc1N(C)c1cccc2c1oc1ccccc12.CCc1ccccc1N(C)c1cccc2c1oc1ccccc12.CN(c1ccc(-c2ccccc2)cc1-c1ccccc1)c1cccc2c1sc1ccccc12.CN(c1cccc(-c2ccccc2)c1)c1cccc2c1sc1ccccc12.CN(c1ccccc1C(C)(C)C)c1cccc2c1oc1ccccc12.CN(c1ccccc1F)c1cccc2c1oc1ccccc12.Cc1ccccc1N(C)c1cccc2c1oc1ccccc12.
What is the InChIKey of N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
The InChIKey is LOCIAZJVWDTWTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23NS.C25H19NS.C23H23NO.C22H21NO.C21H19NO.C20H17NO.C19H14FNO/c1-32(29-17-10-16-26-25-15-8-9-18-30(25)33-31(26)29)28-20-19-24(22-11-4-2-5-12-22)21-27(28)23-13-6-3-7-14-23;1-26(20-12-7-11-19(17-20)18-9-3-2-4-10-18)23-15-8-14-22-21-13-5-6-16-24(21)27-25(22)23;1-23(2,3)18-12-6-7-13-19(18)24(4)20-14-9-11-17-16-10-5-8-15-21(16)25-22(17)20;1-15(2)16-9-4-6-12-19(16)23(3)20-13-8-11-18-17-10-5-7-14-21(17)24-22(18)20;1-3-15-9-4-6-12-18(15)22(2)19-13-8-11-17-16-10-5-7-14-20(16)23-21(17)19;1-14-8-3-5-11-17(14)21(2)18-12-7-10-16-15-9-4-6-13-19(15)22-20(16)18;1-21(16-10-4-3-9-15(16)20)17-11-6-8-14-13-7-2-5-12-18(13)22-19(14)17/h2-21H,1H3;2-17H,1H3;5-15H,1-4H3;4-15H,1-3H3;4-14H,3H2,1-2H3;3-13H,1-2H3;2-12H,1H3.
What are the key properties of N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine has a molecular weight of 2332.03 g/mol, XLogP of 46.85, 19 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-N-methyldibenzofuran-4-amine;N-(2,4-diphenylphenyl)-N-methyldibenzothiophen-4-amine;N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine;N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine;N-methyl-N-(2-methylphenyl)dibenzofuran-4-amine;N-methyl-N-(3-phenylphenyl)dibenzothiophen-4-amine;N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 159407129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).