(1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium

C74H169N14+7 — CID 162289806

About (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium

(1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium (PubChem CID 162289806) has the molecular formula C74H169N14+7 and a molecular weight of 1255.26 g/mol. Its IUPAC name is (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium.

Molecular Properties

• Compound Name: (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium
• PubChem CID: 162289806
• Molecular Formula: C74H169N14+7
• Molecular Weight: 1255.26 g/mol
• Exact Mass: 1254.36
• IUPAC Name: (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium
• SMILES: CCC1CN(C(C)C)C[N@+]1(C)CC.CCC1C[N@@+](C)(CC)CN1C(C)C.CCC1C[N@@+](C)(CC)CN1CC.CCCC1CN(CC)C[N@+]1(C)CC.CCCC1C[N@@+](C)(CC)CN1CC.CC[N@+]1(C)CC(C)N(C(C)C)C1.CC[N@@+]1(C)CN(C(C)C)CC1C
• InChI: InChI=1S/4C11H25N2.3C10H23N2/c1-6-11-8-13(5,7-2)9-12(11)10(3)4;1-6-11-8-12(10(3)4)9-13(11,5)7-2;1-5-8-11-9-13(4,7-3)10-12(11)6-2;1-5-8-11-9-12(6-2)10-13(11,4)7-3;1-6-12(5)7-10(4)11(8-12)9(2)3;1-6-12(5)8-11(9(2)3)7-10(12)4;1-5-10-8-12(4,7-3)9-11(10)6-2/h2*10-11H,6-9H2,1-5H3;2*11H,5-10H2,1-4H3;2*9-10H,6-8H2,1-5H3;10H,5-9H2,1-4H3/q7*+1/t4*11?,13-;3*10?,12-/m1010101/s1
• InChIKey: WYROMXVLFMHPQV-DIGJBJKGSA-N
• XLogP: 12.23
• TPSA: 22.68 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 21
• Heavy Atoms: 88
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1255.26
LogP ≤ 5	12.23
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium?

The IUPAC name of (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium (CID 162289806) is (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium.

What is the SMILES notation for (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium?

The canonical SMILES for (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium is CCC1CN(C(C)C)C[N@+]1(C)CC.CCC1C[N@@+](C)(CC)CN1C(C)C.CCC1C[N@@+](C)(CC)CN1CC.CCCC1CN(CC)C[N@+]1(C)CC.CCCC1C[N@@+](C)(CC)CN1CC.CC[N@+]1(C)CC(C)N(C(C)C)C1.CC[N@@+]1(C)CN(C(C)C)CC1C.

What is the InChIKey of (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium?

The InChIKey is WYROMXVLFMHPQV-DIGJBJKGSA-N. The full InChI is InChI=1S/4C11H25N2.3C10H23N2/c1-6-11-8-13(5,7-2)9-12(11)10(3)4;1-6-11-8-12(10(3)4)9-13(11,5)7-2;1-5-8-11-9-13(4,7-3)10-12(11)6-2;1-5-8-11-9-12(6-2)10-13(11,4)7-3;1-6-12(5)7-10(4)11(8-12)9(2)3;1-6-12(5)8-11(9(2)3)7-10(12)4;1-5-10-8-12(4,7-3)9-11(10)6-2/h2*10-11H,6-9H2,1-5H3;2*11H,5-10H2,1-4H3;2*9-10H,6-8H2,1-5H3;10H,5-9H2,1-4H3/q7*+1/t4*11?,13-;3*10?,12-/m1010101/s1.

What are the key properties of (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium?

(1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium has a molecular weight of 1255.26 g/mol, XLogP of 12.23, 21 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (1R)-1,4-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,5-diethyl-1-methyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-4-propylimidazolidin-1-ium;(1R)-1,3-diethyl-1-methyl-5-propylimidazolidin-1-ium;(1R)-1-ethyl-1,4-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1-ethyl-1,5-dimethyl-3-propan-2-ylimidazolidin-1-ium;(1R)-1,3,4-triethyl-1-methylimidazolidin-1-ium is sourced from PubChem (CID 162289806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).