5-cyclohexyl-2,3-diethylimidazol-4-amine

C13H23N3 — CID 62226573

IUPAC5-cyclohexyl-2,3-diethylimidazol-4-amine
SMILESCCc1nc(C2CCCCC2)c(N)n1CC
InChIInChI=1S/C13H23N3/c1-3-11-15-12(13(14)16(11)4-2)10-8-6-5-7-9-10/h10H,3-9,14H2,1-2H3
InChIKeyYRAOLEDXZLRMSY-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.10
Rot. Bonds3

About 5-cyclohexyl-2,3-diethylimidazol-4-amine

5-cyclohexyl-2,3-diethylimidazol-4-amine (PubChem CID 62226573) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 5-cyclohexyl-2,3-diethylimidazol-4-amine.

Molecular Properties

Compound Name5-cyclohexyl-2,3-diethylimidazol-4-amine
PubChem CID62226573
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name5-cyclohexyl-2,3-diethylimidazol-4-amine
SMILESCCc1nc(C2CCCCC2)c(N)n1CC
InChIInChI=1S/C13H23N3/c1-3-11-15-12(13(14)16(11)4-2)10-8-6-5-7-9-10/h10H,3-9,14H2,1-2H3
InChIKeyYRAOLEDXZLRMSY-UHFFFAOYSA-N
XLogP3.10
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2,3-diethylimidazol-4-amine?
The IUPAC name of 5-cyclohexyl-2,3-diethylimidazol-4-amine (CID 62226573) is 5-cyclohexyl-2,3-diethylimidazol-4-amine.
What is the SMILES notation for 5-cyclohexyl-2,3-diethylimidazol-4-amine?
The canonical SMILES for 5-cyclohexyl-2,3-diethylimidazol-4-amine is CCc1nc(C2CCCCC2)c(N)n1CC.
What is the InChIKey of 5-cyclohexyl-2,3-diethylimidazol-4-amine?
The InChIKey is YRAOLEDXZLRMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-3-11-15-12(13(14)16(11)4-2)10-8-6-5-7-9-10/h10H,3-9,14H2,1-2H3.
What are the key properties of 5-cyclohexyl-2,3-diethylimidazol-4-amine?
5-cyclohexyl-2,3-diethylimidazol-4-amine has a molecular weight of 221.35 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2,3-diethylimidazol-4-amine is sourced from PubChem (CID 62226573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).