2,3-dimethylaniline;N,N-dimethylmethanamine

C11H20N2 — CID 69304768

IUPAC2,3-dimethylaniline;N,N-dimethylmethanamine
SMILESCN(C)C.Cc1cccc(N)c1C
InChIInChI=1S/C8H11N.C3H9N/c1-6-4-3-5-8(9)7(6)2;1-4(2)3/h3-5H,9H2,1-2H3;1-3H3
InChIKeyHZJPFDOXCNRAGU-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.06
Rot. Bonds

About 2,3-dimethylaniline;N,N-dimethylmethanamine

2,3-dimethylaniline;N,N-dimethylmethanamine (PubChem CID 69304768) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 2,3-dimethylaniline;N,N-dimethylmethanamine.

Molecular Properties

Compound Name2,3-dimethylaniline;N,N-dimethylmethanamine
PubChem CID69304768
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name2,3-dimethylaniline;N,N-dimethylmethanamine
SMILESCN(C)C.Cc1cccc(N)c1C
InChIInChI=1S/C8H11N.C3H9N/c1-6-4-3-5-8(9)7(6)2;1-4(2)3/h3-5H,9H2,1-2H3;1-3H3
InChIKeyHZJPFDOXCNRAGU-UHFFFAOYSA-N
XLogP2.06
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3-dimethylaniline;ethane
CID 142025904
2,3-dimethylaniline;sulfur dioxide
CID 154998449
2,3-dimethylaniline;sulfur trioxide
CID 174311736
2,3-dimethylaniline;formic acid
CID 66886773
N,N-dimethylmethanamine;2-methylaniline
CID 174412120
N-benzyl-1-phenylmethanamine;2,3-dimethylaniline
CID 70576853
3-(3-amino-2-methylphenyl)-2-methylaniline
CID 15336123
3-methylbenzene-1,2-diamine
CID 162019775
2,3-dimethylaniline;2,3,4-trideuterio-5-methyl-6-(trideuteriomethyl)aniline
CID 159444672
ethane;1,2,3-trimethylbenzene
CID 54068667
benzene;1,2,3-trimethylbenzene
CID 159605245
2-methylaniline;dihydrochloride
CID 23331471

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylaniline;N,N-dimethylmethanamine?
The IUPAC name of 2,3-dimethylaniline;N,N-dimethylmethanamine (CID 69304768) is 2,3-dimethylaniline;N,N-dimethylmethanamine.
What is the SMILES notation for 2,3-dimethylaniline;N,N-dimethylmethanamine?
The canonical SMILES for 2,3-dimethylaniline;N,N-dimethylmethanamine is CN(C)C.Cc1cccc(N)c1C.
What is the InChIKey of 2,3-dimethylaniline;N,N-dimethylmethanamine?
The InChIKey is HZJPFDOXCNRAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C3H9N/c1-6-4-3-5-8(9)7(6)2;1-4(2)3/h3-5H,9H2,1-2H3;1-3H3.
What are the key properties of 2,3-dimethylaniline;N,N-dimethylmethanamine?
2,3-dimethylaniline;N,N-dimethylmethanamine has a molecular weight of 180.29 g/mol, XLogP of 2.06, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylaniline;N,N-dimethylmethanamine is sourced from PubChem (CID 69304768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).