CID 138691650

C9H13LiN — CID 138691650

IUPAC—
SMILESCc1cccc(N(C)C)c1.[Li]
InChIInChI=1S/C9H13N.Li/c1-8-5-4-6-9(7-8)10(2)3;/h4-7H,1-3H3;
InChIKeyFSSPHVKVFOXYCC-UHFFFAOYSA-N
MW142.15 g/mol
LogP1.68
Rot. Bonds1

About CID 138691650

CID 138691650 (PubChem CID 138691650) has the molecular formula C9H13LiN and a molecular weight of 142.15 g/mol.

Molecular Properties

Compound NameCID 138691650
PubChem CID138691650
Molecular FormulaC9H13LiN
Molecular Weight142.15 g/mol
Exact Mass142.12
IUPAC Name—
SMILESCc1cccc(N(C)C)c1.[Li]
InChIInChI=1S/C9H13N.Li/c1-8-5-4-6-9(7-8)10(2)3;/h4-7H,1-3H3;
InChIKeyFSSPHVKVFOXYCC-UHFFFAOYSA-N
XLogP1.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.15
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze CID 138691650 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

N,N-diethylaniline;N,N,3-trimethylaniline
CID 67788378
ethane;1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
CID 90858464
CID 145278615
CID 145278615
CID 70331685
CID 70331685
1-N-[4-(3-methyl-N-(3-methylphenyl)anilino)phenyl]-1-N,4-N,4-N-tris(3-methylphenyl)benzene-1,4-diamine
CID 20734413
N,N'-dimethyl-N'-(3-methylphenyl)methanediamine
CID 115226747
N,3-dimethyl-N-(methylideneamino)aniline
CID 90709546
N-methyl-N-(3-methylphenyl)ethanimidamide
CID 63173195
1-N,1-N'-dimethyl-1-N,1-N'-bis(3-methylphenyl)prop-1-ene-1,1-diamine
CID 70524092
CID 138691667
CID 138691667
ethane;3-methyl-N,N-diphenylaniline
CID 145208007
N-(3-methoxyphenyl)-N,3-dimethylaniline
CID 57317971

Frequently Asked Questions

What is the IUPAC name of CID 138691650?
The IUPAC name of CID 138691650 (CID 138691650) is not available.
What is the SMILES notation for CID 138691650?
The canonical SMILES for CID 138691650 is Cc1cccc(N(C)C)c1.[Li].
What is the InChIKey of CID 138691650?
The InChIKey is FSSPHVKVFOXYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N.Li/c1-8-5-4-6-9(7-8)10(2)3;/h4-7H,1-3H3;.
What are the key properties of CID 138691650?
CID 138691650 has a molecular weight of 142.15 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 138691650 is sourced from PubChem (CID 138691650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).