N,N,1,3-tetramethylimidazolidin-1-ium-1-amine

C7H18N3+ — CID 175539257

IUPACN,N,1,3-tetramethylimidazolidin-1-ium-1-amine
SMILESCN1CC[N+](C)(N(C)C)C1
InChIInChI=1S/C7H18N3/c1-8(2)10(4)6-5-9(3)7-10/h5-7H2,1-4H3/q+1
InChIKeyLPMMXATWXLMNRV-UHFFFAOYSA-N
MW144.24 g/mol
LogP-0.19
Rot. Bonds1

About N,N,1,3-tetramethylimidazolidin-1-ium-1-amine

N,N,1,3-tetramethylimidazolidin-1-ium-1-amine (PubChem CID 175539257) has the molecular formula C7H18N3+ and a molecular weight of 144.24 g/mol. Its IUPAC name is N,N,1,3-tetramethylimidazolidin-1-ium-1-amine.

Molecular Properties

Compound NameN,N,1,3-tetramethylimidazolidin-1-ium-1-amine
PubChem CID175539257
Molecular FormulaC7H18N3+
Molecular Weight144.24 g/mol
Exact Mass144.15
IUPAC NameN,N,1,3-tetramethylimidazolidin-1-ium-1-amine
SMILESCN1CC[N+](C)(N(C)C)C1
InChIInChI=1S/C7H18N3/c1-8(2)10(4)6-5-9(3)7-10/h5-7H2,1-4H3/q+1
InChIKeyLPMMXATWXLMNRV-UHFFFAOYSA-N
XLogP-0.19
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.24
LogP ≤ 5-0.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-Dimethylimidazolidine
CID 12190571
1,3-Diethylimidazolidine
CID 581242
1,1,3,3-Tetramethylimidazolidine-1,3-diium
CID 13976344
N,n,1,3-tetramethylimidazolidin-2-amine
CID 12601919
1-Methyl-3-nitrosoimidazolidine
CID 14906185
1,2,3,4-Tetramethyl-1,2,4-triazolidine
CID 18338490
1-Ethyl-2,3-dimethylimidazolidine
CID 21478047
1,1,3-Trimethylimidazolidin-1-ium
CID 57723178
1,2,3,4,5-Pentamethyl-1,2,4-triazolidine
CID 59881570
CID 59923857
CID 59923857
1-Ethyl-1,3-dimethylimidazolidin-1-ium
CID 89173636
1,3-Dimethylimidazolidine;ethane
CID 91506469

Frequently Asked Questions

What is the IUPAC name of N,N,1,3-tetramethylimidazolidin-1-ium-1-amine?
The IUPAC name of N,N,1,3-tetramethylimidazolidin-1-ium-1-amine (CID 175539257) is N,N,1,3-tetramethylimidazolidin-1-ium-1-amine.
What is the SMILES notation for N,N,1,3-tetramethylimidazolidin-1-ium-1-amine?
The canonical SMILES for N,N,1,3-tetramethylimidazolidin-1-ium-1-amine is CN1CC[N+](C)(N(C)C)C1.
What is the InChIKey of N,N,1,3-tetramethylimidazolidin-1-ium-1-amine?
The InChIKey is LPMMXATWXLMNRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N3/c1-8(2)10(4)6-5-9(3)7-10/h5-7H2,1-4H3/q+1.
What are the key properties of N,N,1,3-tetramethylimidazolidin-1-ium-1-amine?
N,N,1,3-tetramethylimidazolidin-1-ium-1-amine has a molecular weight of 144.24 g/mol, XLogP of -0.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,3-tetramethylimidazolidin-1-ium-1-amine is sourced from PubChem (CID 175539257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).