6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine

C27H29NO — CID 138651898

IUPAC6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine
SMILESCc1ccc(N(C)c2cccc3c2oc2c(C4CCCCC4)cccc23)c(C)c1
InChIInChI=1S/C27H29NO/c1-18-15-16-24(19(2)17-18)28(3)25-14-8-13-23-22-12-7-11-21(26(22)29-27(23)25)20-9-5-4-6-10-20/h7-8,11-17,20H,4-6,9-10H2,1-3H3
InChIKeyUIZCNGQDLPAIAX-UHFFFAOYSA-N
MW383.54 g/mol
LogP8.02
Rot. Bonds3

About 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine

6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine (PubChem CID 138651898) has the molecular formula C27H29NO and a molecular weight of 383.54 g/mol. Its IUPAC name is 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine.

Molecular Properties

Compound Name6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine
PubChem CID138651898
Molecular FormulaC27H29NO
Molecular Weight383.54 g/mol
Exact Mass383.22
IUPAC Name6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine
SMILESCc1ccc(N(C)c2cccc3c2oc2c(C4CCCCC4)cccc23)c(C)c1
InChIInChI=1S/C27H29NO/c1-18-15-16-24(19(2)17-18)28(3)25-14-8-13-23-22-12-7-11-21(26(22)29-27(23)25)20-9-5-4-6-10-20/h7-8,11-17,20H,4-6,9-10H2,1-3H3
InChIKeyUIZCNGQDLPAIAX-UHFFFAOYSA-N
XLogP8.02
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.54
LogP ≤ 58.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine?
The IUPAC name of 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine (CID 138651898) is 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine.
What is the SMILES notation for 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine?
The canonical SMILES for 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine is Cc1ccc(N(C)c2cccc3c2oc2c(C4CCCCC4)cccc23)c(C)c1.
What is the InChIKey of 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine?
The InChIKey is UIZCNGQDLPAIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29NO/c1-18-15-16-24(19(2)17-18)28(3)25-14-8-13-23-22-12-7-11-21(26(22)29-27(23)25)20-9-5-4-6-10-20/h7-8,11-17,20H,4-6,9-10H2,1-3H3.
What are the key properties of 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine?
6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine has a molecular weight of 383.54 g/mol, XLogP of 8.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-N-(2,4-dimethylphenyl)-N-methyldibenzofuran-4-amine is sourced from PubChem (CID 138651898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).