N,N-dimethylmethanamine;2-methylaniline

C10H18N2 — CID 174412120

IUPACN,N-dimethylmethanamine;2-methylaniline
SMILESCN(C)C.Cc1ccccc1N
InChIInChI=1S/C7H9N.C3H9N/c1-6-4-2-3-5-7(6)8;1-4(2)3/h2-5H,8H2,1H3;1-3H3
InChIKeyOGGRXNCZUKGBNH-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.76
Rot. Bonds

About N,N-dimethylmethanamine;2-methylaniline

N,N-dimethylmethanamine;2-methylaniline (PubChem CID 174412120) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N,N-dimethylmethanamine;2-methylaniline.

Molecular Properties

Compound NameN,N-dimethylmethanamine;2-methylaniline
PubChem CID174412120
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN,N-dimethylmethanamine;2-methylaniline
SMILESCN(C)C.Cc1ccccc1N
InChIInChI=1S/C7H9N.C3H9N/c1-6-4-2-3-5-7(6)8;1-4(2)3/h2-5H,8H2,1H3;1-3H3
InChIKeyOGGRXNCZUKGBNH-UHFFFAOYSA-N
XLogP1.76
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.76
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

CID 175394275
CID 175394275
CID 67897123
CID 67897123
2-methylaniline;dihydrochloride
CID 23331471
CID 159002136
CID 159002136
tris(2-methylaniline);phosphane
CID 158408493
ethane;methanamine;2-methylaniline
CID 91356397
deuteriomethane;2-methylaniline
CID 90744870
2-methylaniline;2-methylpropane
CID 91027920
bis(2-methylaniline);propane
CID 158079245
ethane;2-methylaniline;propane
CID 144801075
2,6-dimethylaniline;2-methylaniline
CID 160714609
2,3-dimethylaniline;N,N-dimethylmethanamine
CID 69304768

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmethanamine;2-methylaniline?
The IUPAC name of N,N-dimethylmethanamine;2-methylaniline (CID 174412120) is N,N-dimethylmethanamine;2-methylaniline.
What is the SMILES notation for N,N-dimethylmethanamine;2-methylaniline?
The canonical SMILES for N,N-dimethylmethanamine;2-methylaniline is CN(C)C.Cc1ccccc1N.
What is the InChIKey of N,N-dimethylmethanamine;2-methylaniline?
The InChIKey is OGGRXNCZUKGBNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N.C3H9N/c1-6-4-2-3-5-7(6)8;1-4(2)3/h2-5H,8H2,1H3;1-3H3.
What are the key properties of N,N-dimethylmethanamine;2-methylaniline?
N,N-dimethylmethanamine;2-methylaniline has a molecular weight of 166.27 g/mol, XLogP of 1.76, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;2-methylaniline is sourced from PubChem (CID 174412120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).