N,3-dimethyl-N-(methylideneamino)aniline

C9H12N2 — CID 90709546

IUPACN,3-dimethyl-N-(methylideneamino)aniline
SMILESC=NN(C)c1cccc(C)c1
InChIInChI=1S/C9H12N2/c1-8-5-4-6-9(7-8)11(3)10-2/h4-7H,2H2,1,3H3
InChIKeyXALPUQAJQFUBPV-UHFFFAOYSA-N
MW148.21 g/mol
LogP2.05
Rot. Bonds2

About N,3-dimethyl-N-(methylideneamino)aniline

N,3-dimethyl-N-(methylideneamino)aniline (PubChem CID 90709546) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is N,3-dimethyl-N-(methylideneamino)aniline.

Molecular Properties

Compound NameN,3-dimethyl-N-(methylideneamino)aniline
PubChem CID90709546
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC NameN,3-dimethyl-N-(methylideneamino)aniline
SMILESC=NN(C)c1cccc(C)c1
InChIInChI=1S/C9H12N2/c1-8-5-4-6-9(7-8)11(3)10-2/h4-7H,2H2,1,3H3
InChIKeyXALPUQAJQFUBPV-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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Related Compounds

3-ethynyl-N-methyl-N-(methylideneamino)aniline
CID 144793198
CID 138691650
CID 138691650
CID 145278615
CID 145278615
CID 70331685
CID 70331685
1-N-[4-(3-methyl-N-(3-methylphenyl)anilino)phenyl]-1-N,4-N,4-N-tris(3-methylphenyl)benzene-1,4-diamine
CID 20734413
N-[(1Z)-buta-1,3-dienyl]-N,3-dimethylaniline
CID 172568637
(Z,4Z)-2,3-dibromo-4-[methyl-(3-methylphenyl)hydrazinylidene]but-2-enal
CID 126535167
1-N,1-N'-dimethyl-1-N,1-N'-bis(3-methylphenyl)prop-1-ene-1,1-diamine
CID 70524092
ethane;3-methyl-N,N-diphenylaniline
CID 145208007
1,2-dimethyl-1-(3-methylphenyl)guanidine;ethane
CID 144789417
N-methyl-N-(3-methylphenyl)pyridin-4-amine
CID 89072633
N-(2-iodoethyl)-N,3-dimethylaniline
CID 130693336

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-(methylideneamino)aniline?
The IUPAC name of N,3-dimethyl-N-(methylideneamino)aniline (CID 90709546) is N,3-dimethyl-N-(methylideneamino)aniline.
What is the SMILES notation for N,3-dimethyl-N-(methylideneamino)aniline?
The canonical SMILES for N,3-dimethyl-N-(methylideneamino)aniline is C=NN(C)c1cccc(C)c1.
What is the InChIKey of N,3-dimethyl-N-(methylideneamino)aniline?
The InChIKey is XALPUQAJQFUBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-8-5-4-6-9(7-8)11(3)10-2/h4-7H,2H2,1,3H3.
What are the key properties of N,3-dimethyl-N-(methylideneamino)aniline?
N,3-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,3-dimethyl-N-(methylideneamino)aniline is sourced from PubChem (CID 90709546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).