lithium 1-methylcyclopentan-1-olate

C6H11LiO — CID 23674466

IUPAClithium 1-methylcyclopentan-1-olate
SMILESCC1([O-])CCCC1.[Li+]
InChIInChI=1S/C6H11O.Li/c1-6(7)4-2-3-5-6;/h2-5H2,1H3;/q-1;+1
InChIKeyDOTMTCHFCFRGIN-UHFFFAOYSA-N
MW106.09 g/mol
LogP-2.32
Rot. Bonds

About lithium 1-methylcyclopentan-1-olate

lithium 1-methylcyclopentan-1-olate (PubChem CID 23674466) has the molecular formula C6H11LiO and a molecular weight of 106.09 g/mol. Its IUPAC name is lithium 1-methylcyclopentan-1-olate.

Molecular Properties

Compound Namelithium 1-methylcyclopentan-1-olate
PubChem CID23674466
Molecular FormulaC6H11LiO
Molecular Weight106.09 g/mol
Exact Mass106.10
IUPAC Namelithium 1-methylcyclopentan-1-olate
SMILESCC1([O-])CCCC1.[Li+]
InChIInChI=1S/C6H11O.Li/c1-6(7)4-2-3-5-6;/h2-5H2,1H3;/q-1;+1
InChIKeyDOTMTCHFCFRGIN-UHFFFAOYSA-N
XLogP-2.32
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.09
LogP ≤ 5-2.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze lithium 1-methylcyclopentan-1-olate 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

1-Methylcyclopentanol
CID 73830
O-(1-methylcyclopentyl)hydroxylamine
CID 21644541
1-Methylcyclopentane-1-peroxol
CID 14745414
1-Methoxy-1-methylcyclopentane
CID 21185399
Dilithium;1-ethylcyclopentan-1-olate
CID 134890394
(1-Methylcyclopentyl) hypochlorite
CID 12810337
Lithium 2-methylhexan-2-olate
CID 23702344
(1-Methylcyclopentyl) hypobromite
CID 53981748
CID 68827924
CID 68827924
(1-Methylcyclopentyl) hypoiodite
CID 134319238
Magnesium;1-methylcyclopentan-1-olate;chloride
CID 140051737
Magnesium;1-ethylcyclopentan-1-olate;fluoride
CID 140051771

Frequently Asked Questions

What is the IUPAC name of lithium 1-methylcyclopentan-1-olate?
The IUPAC name of lithium 1-methylcyclopentan-1-olate (CID 23674466) is lithium 1-methylcyclopentan-1-olate.
What is the SMILES notation for lithium 1-methylcyclopentan-1-olate?
The canonical SMILES for lithium 1-methylcyclopentan-1-olate is CC1([O-])CCCC1.[Li+].
What is the InChIKey of lithium 1-methylcyclopentan-1-olate?
The InChIKey is DOTMTCHFCFRGIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11O.Li/c1-6(7)4-2-3-5-6;/h2-5H2,1H3;/q-1;+1.
What are the key properties of lithium 1-methylcyclopentan-1-olate?
lithium 1-methylcyclopentan-1-olate has a molecular weight of 106.09 g/mol, XLogP of -2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 1-methylcyclopentan-1-olate is sourced from PubChem (CID 23674466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).