lithium 2-methylbenzimidazol-1-ide

C8H7LiN2 — CID 131740995

IUPAClithium 2-methylbenzimidazol-1-ide
SMILESCc1nc2ccccc2[n-]1.[Li+]
InChIInChI=1S/C8H7N2.Li/c1-6-9-7-4-2-3-5-8(7)10-6;/h2-5H,1H3;/q-1;+1
InChIKeyDHOCFZMMKJUWOV-UHFFFAOYSA-N
MW138.10 g/mol
LogP-1.50
Rot. Bonds

About lithium 2-methylbenzimidazol-1-ide

lithium 2-methylbenzimidazol-1-ide (PubChem CID 131740995) has the molecular formula C8H7LiN2 and a molecular weight of 138.10 g/mol. Its IUPAC name is lithium 2-methylbenzimidazol-1-ide.

Molecular Properties

Compound Namelithium 2-methylbenzimidazol-1-ide
PubChem CID131740995
Molecular FormulaC8H7LiN2
Molecular Weight138.10 g/mol
Exact Mass138.08
IUPAC Namelithium 2-methylbenzimidazol-1-ide
SMILESCc1nc2ccccc2[n-]1.[Li+]
InChIInChI=1S/C8H7N2.Li/c1-6-9-7-4-2-3-5-8(7)10-6;/h2-5H,1H3;/q-1;+1
InChIKeyDHOCFZMMKJUWOV-UHFFFAOYSA-N
XLogP-1.50
TPSA26.99 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.10
LogP ≤ 5-1.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

silver 2-methylbenzimidazol-1-ide
CID 46784053
2-methylbenzimidazol-1-ide;yttrium
CID 59098019
2-methylquinazolin-3-id-4-one;yttrium
CID 59938499
copper(1+);2-[6-[(6-methyl-2-pyridinyl)methyl]-2-pyridinyl]benzimidazol-1-ide
CID 140599646
2,3-dimethylpyrazino[2,3-b]phenazine
CID 101041837
silver benzimidazol-1-ide
CID 24939896
hydron;phenazine
CID 175446889
phenazine;silver
CID 175026023
4-[2-[1-(benzimidazol-1-id-2-yl)pyridin-1-ium-4-yl]ethynyl]-N,N-dimethylaniline
CID 177410434
2-methyl-1,3-benzoxazole;hydroiodide
CID 173239449
N-iodo-N-methyl-1,3-benzoxazol-2-amine
CID 142874451
2-methyl-1,3-benzoxazole;prop-1-ene
CID 178101004

Frequently Asked Questions

What is the IUPAC name of lithium 2-methylbenzimidazol-1-ide?
The IUPAC name of lithium 2-methylbenzimidazol-1-ide (CID 131740995) is lithium 2-methylbenzimidazol-1-ide.
What is the SMILES notation for lithium 2-methylbenzimidazol-1-ide?
The canonical SMILES for lithium 2-methylbenzimidazol-1-ide is Cc1nc2ccccc2[n-]1.[Li+].
What is the InChIKey of lithium 2-methylbenzimidazol-1-ide?
The InChIKey is DHOCFZMMKJUWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N2.Li/c1-6-9-7-4-2-3-5-8(7)10-6;/h2-5H,1H3;/q-1;+1.
What are the key properties of lithium 2-methylbenzimidazol-1-ide?
lithium 2-methylbenzimidazol-1-ide has a molecular weight of 138.10 g/mol, XLogP of -1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2-methylbenzimidazol-1-ide is sourced from PubChem (CID 131740995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).