2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine

C15H27N3 — CID 55048700

IUPAC2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine
SMILESCCCn1c(C2CCCCC2)nc(C(C)C)c1N
InChIInChI=1S/C15H27N3/c1-4-10-18-14(16)13(11(2)3)17-15(18)12-8-6-5-7-9-12/h11-12H,4-10,16H2,1-3H3
InChIKeyUABGPDBZELRDEI-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.05
Rot. Bonds4

About 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine

2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine (PubChem CID 55048700) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine.

Molecular Properties

Compound Name2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine
PubChem CID55048700
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine
SMILESCCCn1c(C2CCCCC2)nc(C(C)C)c1N
InChIInChI=1S/C15H27N3/c1-4-10-18-14(16)13(11(2)3)17-15(18)12-8-6-5-7-9-12/h11-12H,4-10,16H2,1-3H3
InChIKeyUABGPDBZELRDEI-UHFFFAOYSA-N
XLogP4.05
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine?
The IUPAC name of 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine (CID 55048700) is 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine.
What is the SMILES notation for 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine?
The canonical SMILES for 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine is CCCn1c(C2CCCCC2)nc(C(C)C)c1N.
What is the InChIKey of 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine?
The InChIKey is UABGPDBZELRDEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-10-18-14(16)13(11(2)3)17-15(18)12-8-6-5-7-9-12/h11-12H,4-10,16H2,1-3H3.
What are the key properties of 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine?
2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine has a molecular weight of 249.40 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine is sourced from PubChem (CID 55048700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).