6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine

C28H31NO — CID 134527995

IUPAC6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
SMILESCC(C)c1ccccc1N(C)c1cccc2c1oc1c(C3CCCCC3)cccc12
InChIInChI=1S/C28H31NO/c1-19(2)21-13-7-8-17-25(21)29(3)26-18-10-16-24-23-15-9-14-22(27(23)30-28(24)26)20-11-5-4-6-12-20/h7-10,13-20H,4-6,11-12H2,1-3H3
InChIKeyABHMAWQWSVFGJY-UHFFFAOYSA-N
MW397.56 g/mol
LogP8.52
Rot. Bonds4

About 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine

6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine (PubChem CID 134527995) has the molecular formula C28H31NO and a molecular weight of 397.56 g/mol. Its IUPAC name is 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound Name6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
PubChem CID134527995
Molecular FormulaC28H31NO
Molecular Weight397.56 g/mol
Exact Mass397.24
IUPAC Name6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
SMILESCC(C)c1ccccc1N(C)c1cccc2c1oc1c(C3CCCCC3)cccc12
InChIInChI=1S/C28H31NO/c1-19(2)21-13-7-8-17-25(21)29(3)26-18-10-16-24-23-15-9-14-22(27(23)30-28(24)26)20-11-5-4-6-12-20/h7-10,13-20H,4-6,11-12H2,1-3H3
InChIKeyABHMAWQWSVFGJY-UHFFFAOYSA-N
XLogP8.52
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.56
LogP ≤ 58.52
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-cyclopentyl-N-methyl-N-phenyldibenzofuran-4-amine
CID 138456793
6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine
CID 138651898
6-tert-butyl-N-(2-cyclohexylphenyl)-N-methyldibenzofuran-4-amine
CID 134527983
6-tert-butyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
CID 134527978
4-[(6-cyclopentyldibenzofuran-4-yl)-methylamino]benzonitrile
CID 138456777
N-(2-ethylphenyl)-N-methyl-6-propan-2-yldibenzofuran-4-amine
CID 138651496
6-cyclohexyl-N-iodo-N-(4-methylphenyl)dibenzofuran-4-amine
CID 166813401
N-iodo-6-propan-2-yl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine
CID 137416612
N-methyl-N-(4-methylphenyl)-6-propan-2-yldibenzofuran-4-amine
CID 138456794
1-N,6-N-bis(6-cyclohexyldibenzofuran-4-yl)-1-N-[4-(iodomethyl)phenyl]-6-N-(4-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 144918952
4-N,20-N-bis(6-cyclopentyldibenzofuran-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
CID 90263193

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
The IUPAC name of 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine (CID 134527995) is 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
The canonical SMILES for 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine is CC(C)c1ccccc1N(C)c1cccc2c1oc1c(C3CCCCC3)cccc12.
What is the InChIKey of 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
The InChIKey is ABHMAWQWSVFGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H31NO/c1-19(2)21-13-7-8-17-25(21)29(3)26-18-10-16-24-23-15-9-14-22(27(23)30-28(24)26)20-11-5-4-6-12-20/h7-10,13-20H,4-6,11-12H2,1-3H3.
What are the key properties of 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine?
6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine has a molecular weight of 397.56 g/mol, XLogP of 8.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-N-methyl-N-(2-propan-2-ylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 134527995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).