3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine

C18H33N3 — CID 63467488

IUPAC3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine
SMILESCCCCn1c(C2CCCCC2)nc(CC(C)(C)C)c1N
InChIInChI=1S/C18H33N3/c1-5-6-12-21-16(19)15(13-18(2,3)4)20-17(21)14-10-8-7-9-11-14/h14H,5-13,19H2,1-4H3
InChIKeyRIDZYVFLRLLSIJ-UHFFFAOYSA-N
MW291.48 g/mol
LogP4.90
Rot. Bonds5

About 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine

3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine (PubChem CID 63467488) has the molecular formula C18H33N3 and a molecular weight of 291.48 g/mol. Its IUPAC name is 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine.

Molecular Properties

Compound Name3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine
PubChem CID63467488
Molecular FormulaC18H33N3
Molecular Weight291.48 g/mol
Exact Mass291.27
IUPAC Name3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine
SMILESCCCCn1c(C2CCCCC2)nc(CC(C)(C)C)c1N
InChIInChI=1S/C18H33N3/c1-5-6-12-21-16(19)15(13-18(2,3)4)20-17(21)14-10-8-7-9-11-14/h14H,5-13,19H2,1-4H3
InChIKeyRIDZYVFLRLLSIJ-UHFFFAOYSA-N
XLogP4.90
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine?
The IUPAC name of 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine (CID 63467488) is 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine.
What is the SMILES notation for 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine?
The canonical SMILES for 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine is CCCCn1c(C2CCCCC2)nc(CC(C)(C)C)c1N.
What is the InChIKey of 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine?
The InChIKey is RIDZYVFLRLLSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3/c1-5-6-12-21-16(19)15(13-18(2,3)4)20-17(21)14-10-8-7-9-11-14/h14H,5-13,19H2,1-4H3.
What are the key properties of 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine?
3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine has a molecular weight of 291.48 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine is sourced from PubChem (CID 63467488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).