2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde

C11H16N2O — CID 166857709

IUPAC2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde
SMILESCNC(C=O)c1ccccc1N(C)C
InChIInChI=1S/C11H16N2O/c1-12-10(8-14)9-6-4-5-7-11(9)13(2)3/h4-8,10,12H,1-3H3
InChIKeyVPWUTDINRNQCKX-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.21
Rot. Bonds4

About 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde

2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde (PubChem CID 166857709) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde.

Molecular Properties

Compound Name2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde
PubChem CID166857709
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde
SMILESCNC(C=O)c1ccccc1N(C)C
InChIInChI=1S/C11H16N2O/c1-12-10(8-14)9-6-4-5-7-11(9)13(2)3/h4-8,10,12H,1-3H3
InChIKeyVPWUTDINRNQCKX-UHFFFAOYSA-N
XLogP1.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethyl-2-[2,2,2-trifluoro-1-(methylamino)ethyl]aniline
CID 82534647
2-(dibromomethyl)-N,N-dimethylaniline
CID 56618314
2-(methylamino)-2-(4-phenylphenyl)acetaldehyde
CID 116954169
N-[2-(dimethylamino)phenyl]-N-methylformamide
CID 142965400
2-(1-aminopropyl)-N,N-dimethylaniline
CID 112704132
1-N,2-N,2-N-trimethylbenzene-1,2-diamine
CID 533455
2-[bis(4-chlorophenyl)methyl]-N,N-dimethylaniline
CID 23161679
1-N,1-N-dimethyl-3-propan-2-ylbenzene-1,2-diamine
CID 131190038
2-(4-bromophenyl)-2-(methylamino)acetaldehyde
CID 116954131
N-methyl-N-[2-(methylamino)-3-propan-2-ylphenyl]formamide
CID 167190465
1-[4,4-bis[2-(dimethylamino)phenyl]-2-hydroxybut-1-enoxy]-4,4-bis[2-(dimethylamino)phenyl]but-1-en-2-ol
CID 139721068
3-amino-1-[2-(dimethylamino)phenyl]propane-1,2-diol
CID 170828083

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde?
The IUPAC name of 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde (CID 166857709) is 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde.
What is the SMILES notation for 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde?
The canonical SMILES for 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde is CNC(C=O)c1ccccc1N(C)C.
What is the InChIKey of 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde?
The InChIKey is VPWUTDINRNQCKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-12-10(8-14)9-6-4-5-7-11(9)13(2)3/h4-8,10,12H,1-3H3.
What are the key properties of 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde?
2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde has a molecular weight of 192.26 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)phenyl]-2-(methylamino)acetaldehyde is sourced from PubChem (CID 166857709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).