carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))

C8H15N2ORb3 — CID 159375288

IUPACcarbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))
SMILESCNC(C)=O.[C-]1=NC=CC1.[CH3-].[H-].[Rb+].[Rb+].[Rb+]
InChIInChI=1S/C4H4N.C3H7NO.CH3.3Rb.H/c1-2-4-5-3-1;1-3(5)4-2;;;;;/h1,3H,2H2;1-2H3,(H,4,5);1H3;;;;/q-1;;-1;3*+1;-1
InChIKeyNCILIFWJSSNFDT-UHFFFAOYSA-N
MW411.63 g/mol
LogP-7.82
Rot. Bonds

About carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))

carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)) (PubChem CID 159375288) has the molecular formula C8H15N2ORb3 and a molecular weight of 411.63 g/mol. Its IUPAC name is carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)).

Molecular Properties

Compound Namecarbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))
PubChem CID159375288
Molecular FormulaC8H15N2ORb3
Molecular Weight411.63 g/mol
Exact Mass409.85
IUPAC Namecarbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))
SMILESCNC(C)=O.[C-]1=NC=CC1.[CH3-].[H-].[Rb+].[Rb+].[Rb+]
InChIInChI=1S/C4H4N.C3H7NO.CH3.3Rb.H/c1-2-4-5-3-1;1-3(5)4-2;;;;;/h1,3H,2H2;1-2H3,(H,4,5);1H3;;;;/q-1;;-1;3*+1;-1
InChIKeyNCILIFWJSSNFDT-UHFFFAOYSA-N
XLogP-7.82
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.63
LogP ≤ 5-7.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)) with MolForge

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

Launch Full Analysis

Related Compounds

ethane;N-methylacetamide;2-methyl-3H-pyrrole
CID 161394735
N-[(Z)-4-(ethylideneamino)but-3-enyl]acetamide
CID 143723816

Frequently Asked Questions

What is the IUPAC name of carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))?
The IUPAC name of carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)) (CID 159375288) is carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)).
What is the SMILES notation for carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))?
The canonical SMILES for carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)) is CNC(C)=O.[C-]1=NC=CC1.[CH3-].[H-].[Rb+].[Rb+].[Rb+].
What is the InChIKey of carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))?
The InChIKey is NCILIFWJSSNFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N.C3H7NO.CH3.3Rb.H/c1-2-4-5-3-1;1-3(5)4-2;;;;;/h1,3H,2H2;1-2H3,(H,4,5);1H3;;;;/q-1;;-1;3*+1;-1.
What are the key properties of carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+))?
carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)) has a molecular weight of 411.63 g/mol, XLogP of -7.82, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;2,3-dihydropyrrol-2-ide;hydride;N-methylacetamide;tris(rubidium(1+)) is sourced from PubChem (CID 159375288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).