N,4-dimethyl-N-(methylideneamino)aniline

C9H12N2 — CID 142819454

IUPACN,4-dimethyl-N-(methylideneamino)aniline
SMILESC=NN(C)c1ccc(C)cc1
InChIInChI=1S/C9H12N2/c1-8-4-6-9(7-5-8)11(3)10-2/h4-7H,2H2,1,3H3
InChIKeyDQTUBSZUSOEXOX-UHFFFAOYSA-N
MW148.21 g/mol
LogP2.05
Rot. Bonds2

About N,4-dimethyl-N-(methylideneamino)aniline

N,4-dimethyl-N-(methylideneamino)aniline (PubChem CID 142819454) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is N,4-dimethyl-N-(methylideneamino)aniline.

Molecular Properties

Compound NameN,4-dimethyl-N-(methylideneamino)aniline
PubChem CID142819454
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC NameN,4-dimethyl-N-(methylideneamino)aniline
SMILESC=NN(C)c1ccc(C)cc1
InChIInChI=1S/C9H12N2/c1-8-4-6-9(7-5-8)11(3)10-2/h4-7H,2H2,1,3H3
InChIKeyDQTUBSZUSOEXOX-UHFFFAOYSA-N
XLogP2.05
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 52.05
H-Bond Donors ≤ 50
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 N,4-dimethyl-N-(methylideneamino)aniline?
The IUPAC name of N,4-dimethyl-N-(methylideneamino)aniline (CID 142819454) is N,4-dimethyl-N-(methylideneamino)aniline.
What is the SMILES notation for N,4-dimethyl-N-(methylideneamino)aniline?
The canonical SMILES for N,4-dimethyl-N-(methylideneamino)aniline is C=NN(C)c1ccc(C)cc1.
What is the InChIKey of N,4-dimethyl-N-(methylideneamino)aniline?
The InChIKey is DQTUBSZUSOEXOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-8-4-6-9(7-5-8)11(3)10-2/h4-7H,2H2,1,3H3.
What are the key properties of N,4-dimethyl-N-(methylideneamino)aniline?
N,4-dimethyl-N-(methylideneamino)aniline has a molecular weight of 148.21 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-(methylideneamino)aniline is sourced from PubChem (CID 142819454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).