lithium azanidacycloheptane

C6H12LiN — CID 11105324

IUPAClithium azanidacycloheptane
SMILESC1CCC[N-]CC1.[Li+]
InChIInChI=1S/C6H12N.Li/c1-2-4-6-7-5-3-1;/h1-6H2;/q-1;+1
InChIKeyUANQEZRLOVWKTN-UHFFFAOYSA-N
MW105.11 g/mol
LogP-1.06
Rot. Bonds

About lithium azanidacycloheptane

lithium azanidacycloheptane (PubChem CID 11105324) has the molecular formula C6H12LiN and a molecular weight of 105.11 g/mol. Its IUPAC name is lithium azanidacycloheptane.

Molecular Properties

Compound Namelithium azanidacycloheptane
PubChem CID11105324
Molecular FormulaC6H12LiN
Molecular Weight105.11 g/mol
Exact Mass105.11
IUPAC Namelithium azanidacycloheptane
SMILESC1CCC[N-]CC1.[Li+]
InChIInChI=1S/C6H12N.Li/c1-2-4-6-7-5-3-1;/h1-6H2;/q-1;+1
InChIKeyUANQEZRLOVWKTN-UHFFFAOYSA-N
XLogP-1.06
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.11
LogP ≤ 5-1.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

iron(3+);piperidin-1-ide
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iron(4+);tetrakis(piperidin-1-ide)
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azanidacycloheptane;tungsten
CID 156681038
molybdenum(2+);piperidin-1-ide;pyrrolidin-1-ide
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CID 20687678
bis(piperidin-1-ide);trichlororhodium
CID 54604493
difluorozirconium(2+);bis(piperidin-1-ide)
CID 173243334
nickel(2+);1,4,8,11-tetrazanidacyclopentadecane
CID 50896977
cobalt;bis(piperidin-1-ide);diisothiocyanate
CID 54610742
carbon monoxide;chromium(6+);pyrrolidin-1-ide
CID 4210612
zinc;tetrakis(piperidin-1-ide);thiocyanic acid
CID 54605103
CID 6329161
CID 6329161

Frequently Asked Questions

What is the IUPAC name of lithium azanidacycloheptane?
The IUPAC name of lithium azanidacycloheptane (CID 11105324) is lithium azanidacycloheptane.
What is the SMILES notation for lithium azanidacycloheptane?
The canonical SMILES for lithium azanidacycloheptane is C1CCC[N-]CC1.[Li+].
What is the InChIKey of lithium azanidacycloheptane?
The InChIKey is UANQEZRLOVWKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N.Li/c1-2-4-6-7-5-3-1;/h1-6H2;/q-1;+1.
What are the key properties of lithium azanidacycloheptane?
lithium azanidacycloheptane has a molecular weight of 105.11 g/mol, XLogP of -1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium azanidacycloheptane is sourced from PubChem (CID 11105324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).