lithium 1-methylcyclopentan-1-ol

C6H12LiO+ — CID 18764027

IUPAClithium 1-methylcyclopentan-1-ol
SMILESCC1(O)CCCC1.[Li+]
InChIInChI=1S/C6H12O.Li/c1-6(7)4-2-3-5-6;/h7H,2-5H2,1H3;/q;+1
InChIKeyNVRTVSVDJJWKIO-UHFFFAOYSA-N
MW107.10 g/mol
LogP-1.68
Rot. Bonds

About lithium 1-methylcyclopentan-1-ol

lithium 1-methylcyclopentan-1-ol (PubChem CID 18764027) has the molecular formula C6H12LiO+ and a molecular weight of 107.10 g/mol. Its IUPAC name is lithium 1-methylcyclopentan-1-ol.

Molecular Properties

Compound Namelithium 1-methylcyclopentan-1-ol
PubChem CID18764027
Molecular FormulaC6H12LiO+
Molecular Weight107.10 g/mol
Exact Mass107.10
IUPAC Namelithium 1-methylcyclopentan-1-ol
SMILESCC1(O)CCCC1.[Li+]
InChIInChI=1S/C6H12O.Li/c1-6(7)4-2-3-5-6;/h7H,2-5H2,1H3;/q;+1
InChIKeyNVRTVSVDJJWKIO-UHFFFAOYSA-N
XLogP-1.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.10
LogP ≤ 5-1.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cerium;1-methylcyclohexan-1-ol
CID 146687678
acetylene;1-methylcyclohexan-1-ol
CID 142432034
lithium;hydride;1-methylcyclobutan-1-ol
CID 173114997
formic acid;1-methylcyclohexan-1-ol
CID 163667859
dihydroxy(oxo)vanadium;1-methylcyclohexan-1-ol
CID 19770518
5-methyl-1-phosphanylazocan-5-ol
CID 137426005
(3S)-3-methylpiperidin-3-ol;hydrochloride
CID 138393705
1-cyclohexylethanol;1-methylcyclooctan-1-ol
CID 18968457
4-methyl-1,1-dioxothian-4-ol
CID 58387715
4-methyl-1-pyrrolidin-1-ylsulfonylazepan-4-ol
CID 107407041
4-hydroxy-4-methylazepane-1-sulfonamide
CID 107406904
(5R,10R)-4,4,10-trimethylspiro[4.5]decan-10-ol
CID 102083415

Frequently Asked Questions

What is the IUPAC name of lithium 1-methylcyclopentan-1-ol?
The IUPAC name of lithium 1-methylcyclopentan-1-ol (CID 18764027) is lithium 1-methylcyclopentan-1-ol.
What is the SMILES notation for lithium 1-methylcyclopentan-1-ol?
The canonical SMILES for lithium 1-methylcyclopentan-1-ol is CC1(O)CCCC1.[Li+].
What is the InChIKey of lithium 1-methylcyclopentan-1-ol?
The InChIKey is NVRTVSVDJJWKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.Li/c1-6(7)4-2-3-5-6;/h7H,2-5H2,1H3;/q;+1.
What are the key properties of lithium 1-methylcyclopentan-1-ol?
lithium 1-methylcyclopentan-1-ol has a molecular weight of 107.10 g/mol, XLogP of -1.68, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 1-methylcyclopentan-1-ol is sourced from PubChem (CID 18764027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).