2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine

C18H25N3 — CID 63470019

IUPAC2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine
SMILESCc1cc(C)cc(-c2nc(C3CCCCC3)n(C)c2N)c1
InChIInChI=1S/C18H25N3/c1-12-9-13(2)11-15(10-12)16-17(19)21(3)18(20-16)14-7-5-4-6-8-14/h9-11,14H,4-8,19H2,1-3H3
InChIKeyOQTVFICNNRFMDE-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.33
Rot. Bonds2

About 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine

2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine (PubChem CID 63470019) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine.

Molecular Properties

Compound Name2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine
PubChem CID63470019
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine
SMILESCc1cc(C)cc(-c2nc(C3CCCCC3)n(C)c2N)c1
InChIInChI=1S/C18H25N3/c1-12-9-13(2)11-15(10-12)16-17(19)21(3)18(20-16)14-7-5-4-6-8-14/h9-11,14H,4-8,19H2,1-3H3
InChIKeyOQTVFICNNRFMDE-UHFFFAOYSA-N
XLogP4.33
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine?
The IUPAC name of 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine (CID 63470019) is 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine.
What is the SMILES notation for 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine?
The canonical SMILES for 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine is Cc1cc(C)cc(-c2nc(C3CCCCC3)n(C)c2N)c1.
What is the InChIKey of 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine?
The InChIKey is OQTVFICNNRFMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-12-9-13(2)11-15(10-12)16-17(19)21(3)18(20-16)14-7-5-4-6-8-14/h9-11,14H,4-8,19H2,1-3H3.
What are the key properties of 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine?
2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine has a molecular weight of 283.42 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-(3,5-dimethylphenyl)-3-methylimidazol-4-amine is sourced from PubChem (CID 63470019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).