6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine

C110H116FN5O4Si — CID 158502373

IUPAC6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine
SMILESCN(c1ccc(C#N)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc(C2CCCCC2)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc(F)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc([Si](C)(C)C)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12
InChIInChI=1S/C31H35NO.C28H33NOSi.C26H24N2O.C25H24FNO/c1-32(25-20-18-23(19-21-25)22-10-4-2-5-11-22)29-17-9-16-28-27-15-8-14-26(30(27)33-31(28)29)24-12-6-3-7-13-24;1-29(21-16-18-22(19-17-21)31(2,3)4)26-15-9-14-25-24-13-8-12-23(27(24)30-28(25)26)20-10-6-5-7-11-20;1-28(20-15-13-18(17-27)14-16-20)24-12-6-11-23-22-10-5-9-21(25(22)29-26(23)24)19-7-3-2-4-8-19;1-27(19-15-13-18(26)14-16-19)23-12-6-11-22-21-10-5-9-20(24(21)28-25(22)23)17-7-3-2-4-8-17/h8-9,14-22,24H,2-7,10-13H2,1H3;8-9,12-20H,5-7,10-11H2,1-4H3;5-6,9-16,19H,2-4,7-8H2,1H3;5-6,9-17H,2-4,7-8H2,1H3
InChIKeyHKAWZBDNKWHECR-UHFFFAOYSA-N
MW1619.25 g/mol
LogP32.21
Rot. Bonds14

About 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine

6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine (PubChem CID 158502373) has the molecular formula C110H116FN5O4Si and a molecular weight of 1619.25 g/mol. Its IUPAC name is 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound Name6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine
PubChem CID158502373
Molecular FormulaC110H116FN5O4Si
Molecular Weight1619.25 g/mol
Exact Mass1617.88
IUPAC Name6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine
SMILESCN(c1ccc(C#N)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc(C2CCCCC2)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc(F)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc([Si](C)(C)C)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12
InChIInChI=1S/C31H35NO.C28H33NOSi.C26H24N2O.C25H24FNO/c1-32(25-20-18-23(19-21-25)22-10-4-2-5-11-22)29-17-9-16-28-27-15-8-14-26(30(27)33-31(28)29)24-12-6-3-7-13-24;1-29(21-16-18-22(19-17-21)31(2,3)4)26-15-9-14-25-24-13-8-12-23(27(24)30-28(25)26)20-10-6-5-7-11-20;1-28(20-15-13-18(17-27)14-16-20)24-12-6-11-23-22-10-5-9-21(25(22)29-26(23)24)19-7-3-2-4-8-19;1-27(19-15-13-18(26)14-16-19)23-12-6-11-22-21-10-5-9-20(24(21)28-25(22)23)17-7-3-2-4-8-17/h8-9,14-22,24H,2-7,10-13H2,1H3;8-9,12-20H,5-7,10-11H2,1-4H3;5-6,9-16,19H,2-4,7-8H2,1H3;5-6,9-17H,2-4,7-8H2,1H3
InChIKeyHKAWZBDNKWHECR-UHFFFAOYSA-N
XLogP32.21
TPSA89.31 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms121
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001619.25
LogP ≤ 532.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine with MolForge

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Related Compounds

4-[(6-cyclopentyldibenzofuran-4-yl)-methylamino]benzonitrile
CID 138456777
6-cyclopentyl-N-methyl-N-phenyldibenzofuran-4-amine
CID 138456793
6-cyclohexyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527994
9-N,15-N-bis(6-cyclohexyldibenzofuran-4-yl)-9-N,15-N-bis(4-fluorophenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,15-diamine
CID 90263304
6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
CID 134527995
6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine
CID 138651898
6-cyclohexyl-N-iodo-N-(4-methylphenyl)dibenzofuran-4-amine
CID 166813401
6-N,11-N-bis(6-cyclopentyldibenzofuran-4-yl)-6-N,11-N-bis(4-fluorophenyl)naphtho[3,2-b][1]benzofuran-6,11-diamine
CID 90262625
4-N,20-N-bis(6-cyclohexyldibenzofuran-4-yl)-4-N,20-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-bis(4-fluorophenyl)-4-N,20-N-bis(6-methyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-bis(6-methyldibenzofuran-4-yl)-4-N,20-N-bis(4-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine
CID 158493634
5-N,9-N-bis(6-cyclohexyldibenzofuran-4-yl)-5-N,9-N-bis(4-fluorophenyl)naphtho[2,1-b][1]benzofuran-5,9-diamine
CID 90262742
9-N',15-N'-bis(6-cyclohexyldibenzofuran-4-yl)-9-N',15-N'-bis(4-methylphenyl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9',15'-diamine;9-N',15-N'-bis(6-cyclohexyldibenzofuran-4-yl)-9-N',15-N'-diphenylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9',15'-diamine;N-(6-cyclohexyldibenzofuran-4-yl)-N-(4-fluorophenyl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-ylamino]benzonitrile
CID 165069557
6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine
CID 134527983

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
The IUPAC name of 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine (CID 158502373) is 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
The canonical SMILES for 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine is CN(c1ccc(C#N)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc(C2CCCCC2)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc(F)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.CN(c1ccc([Si](C)(C)C)cc1)c1cccc2c1oc1c(C3CCCCC3)cccc12.
What is the InChIKey of 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
The InChIKey is HKAWZBDNKWHECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H35NO.C28H33NOSi.C26H24N2O.C25H24FNO/c1-32(25-20-18-23(19-21-25)22-10-4-2-5-11-22)29-17-9-16-28-27-15-8-14-26(30(27)33-31(28)29)24-12-6-3-7-13-24;1-29(21-16-18-22(19-17-21)31(2,3)4)26-15-9-14-25-24-13-8-12-23(27(24)30-28(25)26)20-10-6-5-7-11-20;1-28(20-15-13-18(17-27)14-16-20)24-12-6-11-23-22-10-5-9-21(25(22)29-26(23)24)19-7-3-2-4-8-19;1-27(19-15-13-18(26)14-16-19)23-12-6-11-22-21-10-5-9-20(24(21)28-25(22)23)17-7-3-2-4-8-17/h8-9,14-22,24H,2-7,10-13H2,1H3;8-9,12-20H,5-7,10-11H2,1-4H3;5-6,9-16,19H,2-4,7-8H2,1H3;5-6,9-17H,2-4,7-8H2,1H3.
What are the key properties of 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine has a molecular weight of 1619.25 g/mol, XLogP of 32.21, 14 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-N-(4-cyclohexylphenyl)-N-methyldibenzofuran-4-amine;4-[(6-cyclohexyldibenzofuran-4-yl)-methylamino]benzonitrile;6-cyclohexyl-N-(4-fluorophenyl)-N-methyldibenzofuran-4-amine;6-cyclohexyl-N-methyl-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 158502373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).