lithium;N-ethyl-1H-pyrrol-2-amine;hydride

C6H11LiN2 — CID 173205429

IUPAClithium;N-ethyl-1H-pyrrol-2-amine;hydride
SMILESCCNc1ccc[nH]1.[H-].[Li+]
InChIInChI=1S/C6H10N2.Li.H/c1-2-7-6-4-3-5-8-6;;/h3-5,7-8H,2H2,1H3;;/q;+1;-1
InChIKeyGDJWMMIBGDMJNZ-UHFFFAOYSA-N
MW118.11 g/mol
LogP-1.44
Rot. Bonds2

About lithium;N-ethyl-1H-pyrrol-2-amine;hydride

lithium;N-ethyl-1H-pyrrol-2-amine;hydride (PubChem CID 173205429) has the molecular formula C6H11LiN2 and a molecular weight of 118.11 g/mol. Its IUPAC name is lithium;N-ethyl-1H-pyrrol-2-amine;hydride.

Molecular Properties

Compound Namelithium;N-ethyl-1H-pyrrol-2-amine;hydride
PubChem CID173205429
Molecular FormulaC6H11LiN2
Molecular Weight118.11 g/mol
Exact Mass118.11
IUPAC Namelithium;N-ethyl-1H-pyrrol-2-amine;hydride
SMILESCCNc1ccc[nH]1.[H-].[Li+]
InChIInChI=1S/C6H10N2.Li.H/c1-2-7-6-4-3-5-8-6;;/h3-5,7-8H,2H2,1H3;;/q;+1;-1
InChIKeyGDJWMMIBGDMJNZ-UHFFFAOYSA-N
XLogP-1.44
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.11
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium;N-ethyl-1H-pyrrol-2-amine;hydride?
The IUPAC name of lithium;N-ethyl-1H-pyrrol-2-amine;hydride (CID 173205429) is lithium;N-ethyl-1H-pyrrol-2-amine;hydride.
What is the SMILES notation for lithium;N-ethyl-1H-pyrrol-2-amine;hydride?
The canonical SMILES for lithium;N-ethyl-1H-pyrrol-2-amine;hydride is CCNc1ccc[nH]1.[H-].[Li+].
What is the InChIKey of lithium;N-ethyl-1H-pyrrol-2-amine;hydride?
The InChIKey is GDJWMMIBGDMJNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.Li.H/c1-2-7-6-4-3-5-8-6;;/h3-5,7-8H,2H2,1H3;;/q;+1;-1.
What are the key properties of lithium;N-ethyl-1H-pyrrol-2-amine;hydride?
lithium;N-ethyl-1H-pyrrol-2-amine;hydride has a molecular weight of 118.11 g/mol, XLogP of -1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;N-ethyl-1H-pyrrol-2-amine;hydride is sourced from PubChem (CID 173205429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).