2,3,4,5-tetramethyl-N-(methylideneamino)aniline

C11H16N2 — CID 177213177

IUPAC2,3,4,5-tetramethyl-N-(methylideneamino)aniline
SMILESC=NNc1cc(C)c(C)c(C)c1C
InChIInChI=1S/C11H16N2/c1-7-6-11(13-12-5)10(4)9(3)8(7)2/h6,13H,5H2,1-4H3
InChIKeyBAAJFXLIMFMYSD-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.95
Rot. Bonds2

About 2,3,4,5-tetramethyl-N-(methylideneamino)aniline

2,3,4,5-tetramethyl-N-(methylideneamino)aniline (PubChem CID 177213177) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-N-(methylideneamino)aniline.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-N-(methylideneamino)aniline
PubChem CID177213177
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2,3,4,5-tetramethyl-N-(methylideneamino)aniline
SMILESC=NNc1cc(C)c(C)c(C)c1C
InChIInChI=1S/C11H16N2/c1-7-6-11(13-12-5)10(4)9(3)8(7)2/h6,13H,5H2,1-4H3
InChIKeyBAAJFXLIMFMYSD-UHFFFAOYSA-N
XLogP2.95
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethyl-N-(methylideneamino)aniline?
The IUPAC name of 2,3,4,5-tetramethyl-N-(methylideneamino)aniline (CID 177213177) is 2,3,4,5-tetramethyl-N-(methylideneamino)aniline.
What is the SMILES notation for 2,3,4,5-tetramethyl-N-(methylideneamino)aniline?
The canonical SMILES for 2,3,4,5-tetramethyl-N-(methylideneamino)aniline is C=NNc1cc(C)c(C)c(C)c1C.
What is the InChIKey of 2,3,4,5-tetramethyl-N-(methylideneamino)aniline?
The InChIKey is BAAJFXLIMFMYSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-7-6-11(13-12-5)10(4)9(3)8(7)2/h6,13H,5H2,1-4H3.
What are the key properties of 2,3,4,5-tetramethyl-N-(methylideneamino)aniline?
2,3,4,5-tetramethyl-N-(methylideneamino)aniline has a molecular weight of 176.26 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-N-(methylideneamino)aniline is sourced from PubChem (CID 177213177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).