6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine

C29H33NO — CID 134527983

IUPAC6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine
SMILESCN(c1ccccc1C1CCCCC1)c1cccc2c1oc1c(C(C)(C)C)cccc12
InChIInChI=1S/C29H33NO/c1-29(2,3)24-17-10-15-22-23-16-11-19-26(28(23)31-27(22)24)30(4)25-18-9-8-14-21(25)20-12-6-5-7-13-20/h8-11,14-20H,5-7,12-13H2,1-4H3
InChIKeyZBXFKSZCRUJFAX-UHFFFAOYSA-N
MW411.59 g/mol
LogP8.70
Rot. Bonds3

About 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine

6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine (PubChem CID 134527983) has the molecular formula C29H33NO and a molecular weight of 411.59 g/mol. Its IUPAC name is 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine.

Molecular Properties

Compound Name6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine
PubChem CID134527983
Molecular FormulaC29H33NO
Molecular Weight411.59 g/mol
Exact Mass411.26
IUPAC Name6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine
SMILESCN(c1ccccc1C1CCCCC1)c1cccc2c1oc1c(C(C)(C)C)cccc12
InChIInChI=1S/C29H33NO/c1-29(2,3)24-17-10-15-22-23-16-11-19-26(28(23)31-27(22)24)30(4)25-18-9-8-14-21(25)20-12-6-5-7-13-20/h8-11,14-20H,5-7,12-13H2,1-4H3
InChIKeyZBXFKSZCRUJFAX-UHFFFAOYSA-N
XLogP8.70
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.59
LogP ≤ 58.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-cyclohexyl-N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527994
6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
CID 134527995
6-cyclopentyl-N-methyl-N-phenyldibenzofuran-4-amine
CID 138456793
6-tert-butyl-N-methyl-N-(2-trimethylsilylphenyl)dibenzofuran-4-amine
CID 140873226
6-tert-butyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
CID 134527978
6-tert-butyl-N-(2-ethylphenyl)-N-methyldibenzofuran-4-amine
CID 134527976
6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine
CID 138651898
1-N,6-N-bis(6-tert-butyldibenzofuran-4-yl)-3,8-dicyclohexyl-1-N,6-N-diphenylpyrene-1,6-diamine;3,8-dicyclohexyl-1-N,6-N-bis(6-cyclohexyldibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine;3,8-dicyclohexyl-1-N,6-N-bis(6-cyclopentyldibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine;3,8-dicyclohexyl-1-N,6-N-bis(6-methyldibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine
CID 158281555
1-N,6-N-bis(6-tert-butyldibenzofuran-4-yl)-6-N-[4-[2-[4-[(6-tert-butyldibenzofuran-4-yl)-[6-(N-(6-tert-butyldibenzofuran-4-yl)-2-methylanilino)pyren-1-yl]amino]phenyl]propan-2-yl]phenyl]-1-N-(2-methylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-cyclohexyldibenzofuran-4-yl)-1-N-[4-[2-[4-[(6-cyclohexyldibenzofuran-4-yl)-[6-(N-(6-cyclohexyldibenzofuran-4-yl)anilino)pyren-1-yl]amino]phenyl]propan-2-yl]phenyl]-6-N-phenylpyrene-1,6-diamine
CID 162104018
4-[(6-cyclopentyldibenzofuran-4-yl)-methylamino]benzonitrile
CID 138456777
6-tert-butyl-N-methyl-N-[4-(trifluoromethyl)phenyl]dibenzofuran-4-amine
CID 138651769
1-N,6-N-bis(6-tert-butyldibenzofuran-4-yl)-1-N,6-N-bis(3-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(6-cyclohexyldibenzofuran-4-yl)-1-N,6-N-bis(3-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(6-cyclopentyldibenzofuran-4-yl)-1-N,6-N-bis(3-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(6-methyldibenzofuran-4-yl)-1-N,6-N-bis(3-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 158198718

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine?
The IUPAC name of 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine (CID 134527983) is 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine.
What is the SMILES notation for 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine?
The canonical SMILES for 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine is CN(c1ccccc1C1CCCCC1)c1cccc2c1oc1c(C(C)(C)C)cccc12.
What is the InChIKey of 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine?
The InChIKey is ZBXFKSZCRUJFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33NO/c1-29(2,3)24-17-10-15-22-23-16-11-19-26(28(23)31-27(22)24)30(4)25-18-9-8-14-21(25)20-12-6-5-7-13-20/h8-11,14-20H,5-7,12-13H2,1-4H3.
What are the key properties of 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine?
6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine has a molecular weight of 411.59 g/mol, XLogP of 8.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine is sourced from PubChem (CID 134527983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).