triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium

C11H23N2OY+ — CID 160837194

IUPACtriethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium
SMILESCC[N+](CC)(CC)C1(C(=O)NC)CC1.[Y]
InChIInChI=1S/C11H22N2O.Y/c1-5-13(6-2,7-3)11(8-9-11)10(14)12-4;/h5-9H2,1-4H3;/p+1
InChIKeyAFNXAWKNJRQRNZ-UHFFFAOYSA-O
MW288.22 g/mol
LogP1.14
Rot. Bonds5

About triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium

triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium (PubChem CID 160837194) has the molecular formula C11H23N2OY+ and a molecular weight of 288.22 g/mol. Its IUPAC name is triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium.

Molecular Properties

Compound Nametriethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium
PubChem CID160837194
Molecular FormulaC11H23N2OY+
Molecular Weight288.22 g/mol
Exact Mass288.09
IUPAC Nametriethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium
SMILESCC[N+](CC)(CC)C1(C(=O)NC)CC1.[Y]
InChIInChI=1S/C11H22N2O.Y/c1-5-13(6-2,7-3)11(8-9-11)10(14)12-4;/h5-9H2,1-4H3;/p+1
InChIKeyAFNXAWKNJRQRNZ-UHFFFAOYSA-O
XLogP1.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium?
The IUPAC name of triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium (CID 160837194) is triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium.
What is the SMILES notation for triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium?
The canonical SMILES for triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium is CC[N+](CC)(CC)C1(C(=O)NC)CC1.[Y].
What is the InChIKey of triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium?
The InChIKey is AFNXAWKNJRQRNZ-UHFFFAOYSA-O. The full InChI is InChI=1S/C11H22N2O.Y/c1-5-13(6-2,7-3)11(8-9-11)10(14)12-4;/h5-9H2,1-4H3;/p+1.
What are the key properties of triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium?
triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium has a molecular weight of 288.22 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[1-(methylcarbamoyl)cyclopropyl]azanium;yttrium is sourced from PubChem (CID 160837194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).