N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline

C21H30N2O — CID 143169158

IUPACN,N-dimethylmethanamine;ethane;2-methylphenol;quinoline
SMILESCC.CN(C)C.Cc1ccccc1O.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C7H8O.C3H9N.C2H6/c1-2-6-9-8(4-1)5-3-7-10-9;1-6-4-2-3-5-7(6)8;1-4(2)3;1-2/h1-7H;2-5,8H,1H3;1-3H3;1-2H3
InChIKeyXLFKDLSXKIBBJS-UHFFFAOYSA-N
MW326.48 g/mol
LogP5.14
Rot. Bonds

About N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline

N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline (PubChem CID 143169158) has the molecular formula C21H30N2O and a molecular weight of 326.48 g/mol. Its IUPAC name is N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline.

Molecular Properties

Compound NameN,N-dimethylmethanamine;ethane;2-methylphenol;quinoline
PubChem CID143169158
Molecular FormulaC21H30N2O
Molecular Weight326.48 g/mol
Exact Mass326.24
IUPAC NameN,N-dimethylmethanamine;ethane;2-methylphenol;quinoline
SMILESCC.CN(C)C.Cc1ccccc1O.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C7H8O.C3H9N.C2H6/c1-2-6-9-8(4-1)5-3-7-10-9;1-6-4-2-3-5-7(6)8;1-4(2)3;1-2/h1-7H;2-5,8H,1H3;1-3H3;1-2H3
InChIKeyXLFKDLSXKIBBJS-UHFFFAOYSA-N
XLogP5.14
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.48
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline 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-dimethylmethanamine;quinoline
CID 174404526
ethane;methanol;quinoline
CID 90686502
tetrakis(benzene-1,4-diol);quinoline
CID 174523855
quinoline
CID 76974643
bis(2,2-dimethylpropane);ethane;quinoline
CID 159309624
quinoline;tetramethylsilane
CID 91292784
osmium(2+);quinoline
CID 158407120
hydron;quinoline
CID 131854096
quinoline;silver
CID 88761492
CID 175273158
CID 175273158
platinum(2+);quinoline
CID 50910245
CID 159709187
CID 159709187

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline?
The IUPAC name of N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline (CID 143169158) is N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline.
What is the SMILES notation for N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline?
The canonical SMILES for N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline is CC.CN(C)C.Cc1ccccc1O.c1ccc2ncccc2c1.
What is the InChIKey of N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline?
The InChIKey is XLFKDLSXKIBBJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.C7H8O.C3H9N.C2H6/c1-2-6-9-8(4-1)5-3-7-10-9;1-6-4-2-3-5-7(6)8;1-4(2)3;1-2/h1-7H;2-5,8H,1H3;1-3H3;1-2H3.
What are the key properties of N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline?
N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline has a molecular weight of 326.48 g/mol, XLogP of 5.14, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;ethane;2-methylphenol;quinoline is sourced from PubChem (CID 143169158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).