lithium N,N-dimethyl-1-phenylmethanamine

C9H12LiN — CID 10866427

IUPAClithium N,N-dimethyl-1-phenylmethanamine
SMILESCN(C)Cc1[c-]cccc1.[Li+]
InChIInChI=1S/C9H12N.Li/c1-10(2)8-9-6-4-3-5-7-9;/h3-6H,8H2,1-2H3;/q-1;+1
InChIKeyOMNFVLQCFPUFLT-UHFFFAOYSA-N
MW141.14 g/mol
LogP-1.45
Rot. Bonds2

About lithium N,N-dimethyl-1-phenylmethanamine

lithium N,N-dimethyl-1-phenylmethanamine (PubChem CID 10866427) has the molecular formula C9H12LiN and a molecular weight of 141.14 g/mol. Its IUPAC name is lithium N,N-dimethyl-1-phenylmethanamine.

Molecular Properties

Compound Namelithium N,N-dimethyl-1-phenylmethanamine
PubChem CID10866427
Molecular FormulaC9H12LiN
Molecular Weight141.14 g/mol
Exact Mass141.11
IUPAC Namelithium N,N-dimethyl-1-phenylmethanamine
SMILESCN(C)Cc1[c-]cccc1.[Li+]
InChIInChI=1S/C9H12N.Li/c1-10(2)8-9-6-4-3-5-7-9;/h3-6H,8H2,1-2H3;/q-1;+1
InChIKeyOMNFVLQCFPUFLT-UHFFFAOYSA-N
XLogP-1.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 5-1.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of lithium N,N-dimethyl-1-phenylmethanamine?
The IUPAC name of lithium N,N-dimethyl-1-phenylmethanamine (CID 10866427) is lithium N,N-dimethyl-1-phenylmethanamine.
What is the SMILES notation for lithium N,N-dimethyl-1-phenylmethanamine?
The canonical SMILES for lithium N,N-dimethyl-1-phenylmethanamine is CN(C)Cc1[c-]cccc1.[Li+].
What is the InChIKey of lithium N,N-dimethyl-1-phenylmethanamine?
The InChIKey is OMNFVLQCFPUFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.Li/c1-10(2)8-9-6-4-3-5-7-9;/h3-6H,8H2,1-2H3;/q-1;+1.
What are the key properties of lithium N,N-dimethyl-1-phenylmethanamine?
lithium N,N-dimethyl-1-phenylmethanamine has a molecular weight of 141.14 g/mol, XLogP of -1.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium N,N-dimethyl-1-phenylmethanamine is sourced from PubChem (CID 10866427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).