sodium;3,3-dimethylpyrrole;hydride

C6H10NNa — CID 174360500

IUPACsodium;3,3-dimethylpyrrole;hydride
SMILESCC1(C)C=CN=C1.[H-].[Na+]
InChIInChI=1S/C6H9N.Na.H/c1-6(2)3-4-7-5-6;;/h3-5H,1-2H3;;/q;+1;-1
InChIKeyRHEIHZOHNUPQSO-UHFFFAOYSA-N
MW119.14 g/mol
LogP-1.27
Rot. Bonds

About sodium;3,3-dimethylpyrrole;hydride

sodium;3,3-dimethylpyrrole;hydride (PubChem CID 174360500) has the molecular formula C6H10NNa and a molecular weight of 119.14 g/mol. Its IUPAC name is sodium;3,3-dimethylpyrrole;hydride.

Molecular Properties

Compound Namesodium;3,3-dimethylpyrrole;hydride
PubChem CID174360500
Molecular FormulaC6H10NNa
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC Namesodium;3,3-dimethylpyrrole;hydride
SMILESCC1(C)C=CN=C1.[H-].[Na+]
InChIInChI=1S/C6H9N.Na.H/c1-6(2)3-4-7-5-6;;/h3-5H,1-2H3;;/q;+1;-1
InChIKeyRHEIHZOHNUPQSO-UHFFFAOYSA-N
XLogP-1.27
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 5-1.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze sodium;3,3-dimethylpyrrole;hydride 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

5-Fluoro-3,3-dimethylpyrrole
CID 89115699
3-Fluoro-3-methylpyrrole
CID 154640931
2-Fluoro-3,3-dimethylpyrrole
CID 174913653
3-Methyl-3-(1-propenyl)pyrrole
CID 129786932
3,3-Dimethylpyrrole
CID 18759231
N-[(Z)-3,3-dimethylbut-1-enyl]-2,2-dimethylpropan-1-imine
CID 59734363
ethane;3H-pyrrole
CID 91374213
propane;3H-pyrrole
CID 91485586
2,2-dimethylpropane;ethane;3H-pyrrole
CID 91543785
N-[(Z)-3,3-dimethyl-1,2-ditritiobut-1-enyl]-2,2-dimethyl-1-tritiopropan-1-imine
CID 118606013
N-[(Z)-3,3-dimethylbut-1-enyl]ethanimine
CID 123455300
N,2,2-trimethylbut-3-en-1-imine
CID 123546655

Frequently Asked Questions

What is the IUPAC name of sodium;3,3-dimethylpyrrole;hydride?
The IUPAC name of sodium;3,3-dimethylpyrrole;hydride (CID 174360500) is sodium;3,3-dimethylpyrrole;hydride.
What is the SMILES notation for sodium;3,3-dimethylpyrrole;hydride?
The canonical SMILES for sodium;3,3-dimethylpyrrole;hydride is CC1(C)C=CN=C1.[H-].[Na+].
What is the InChIKey of sodium;3,3-dimethylpyrrole;hydride?
The InChIKey is RHEIHZOHNUPQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N.Na.H/c1-6(2)3-4-7-5-6;;/h3-5H,1-2H3;;/q;+1;-1.
What are the key properties of sodium;3,3-dimethylpyrrole;hydride?
sodium;3,3-dimethylpyrrole;hydride has a molecular weight of 119.14 g/mol, XLogP of -1.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;3,3-dimethylpyrrole;hydride is sourced from PubChem (CID 174360500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).