lithium phenyl(propyl)azanide

C9H12LiN — CID 159973083

IUPAClithium phenyl(propyl)azanide
SMILESCCC[N-]c1ccccc1.[Li+]
InChIInChI=1S/C9H12N.Li/c1-2-8-10-9-6-4-3-5-7-9;/h3-7H,2,8H2,1H3;/q-1;+1
InChIKeyOEUOYRGMNTTYGG-UHFFFAOYSA-N
MW141.14 g/mol
LogP0.11
Rot. Bonds3

About lithium phenyl(propyl)azanide

lithium phenyl(propyl)azanide (PubChem CID 159973083) has the molecular formula C9H12LiN and a molecular weight of 141.14 g/mol. Its IUPAC name is lithium phenyl(propyl)azanide.

Molecular Properties

Compound Namelithium phenyl(propyl)azanide
PubChem CID159973083
Molecular FormulaC9H12LiN
Molecular Weight141.14 g/mol
Exact Mass141.11
IUPAC Namelithium phenyl(propyl)azanide
SMILESCCC[N-]c1ccccc1.[Li+]
InChIInChI=1S/C9H12N.Li/c1-2-8-10-9-6-4-3-5-7-9;/h3-7H,2,8H2,1H3;/q-1;+1
InChIKeyOEUOYRGMNTTYGG-UHFFFAOYSA-N
XLogP0.11
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 50.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

butyl(phenyl)azanide;manganese;2-methylpent-2-en-3-ol
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(1-hydroxy-3-phenylpropan-2-yl)-propylazanide;rubidium(1+)
CID 59894889
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chlorotitanium(1+);diphenylazanide
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lithium;methanidylbenzene;pentane
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N-propylaniline
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lithium [(E)-1-ethoxyprop-1-enyl]-phenylazanide
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lithium;ethyne;propylbenzene
CID 174833014
triphenyl(propyl)phosphanium;hydrochloride
CID 118516578
bis(dibutylazanide);methanidylbenzene;titanium(4+)
CID 18315006
bis(dibutylazanide);hafnium(4+);methanidylbenzene
CID 18315045

Frequently Asked Questions

What is the IUPAC name of lithium phenyl(propyl)azanide?
The IUPAC name of lithium phenyl(propyl)azanide (CID 159973083) is lithium phenyl(propyl)azanide.
What is the SMILES notation for lithium phenyl(propyl)azanide?
The canonical SMILES for lithium phenyl(propyl)azanide is CCC[N-]c1ccccc1.[Li+].
What is the InChIKey of lithium phenyl(propyl)azanide?
The InChIKey is OEUOYRGMNTTYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.Li/c1-2-8-10-9-6-4-3-5-7-9;/h3-7H,2,8H2,1H3;/q-1;+1.
What are the key properties of lithium phenyl(propyl)azanide?
lithium phenyl(propyl)azanide has a molecular weight of 141.14 g/mol, XLogP of 0.11, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium phenyl(propyl)azanide is sourced from PubChem (CID 159973083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).