N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide

C11H16N2 — CID 12768124

IUPACN-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide
SMILESCCc1cccc(C)c1N/C=N/C
InChIInChI=1S/C11H16N2/c1-4-10-7-5-6-9(2)11(10)13-8-12-3/h5-8H,4H2,1-3H3,(H,12,13)
InChIKeyYOYYFLHGWYSWDG-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.63
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide

N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide (PubChem CID 12768124) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide
PubChem CID12768124
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC NameN-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide
SMILESCCc1cccc(C)c1N/C=N/C
InChIInChI=1S/C11H16N2/c1-4-10-7-5-6-9(2)11(10)13-8-12-3/h5-8H,4H2,1-3H3,(H,12,13)
InChIKeyYOYYFLHGWYSWDG-UHFFFAOYSA-N
XLogP2.63
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-methyl-N-[2-methyl-6-(3-sulfanylidenepropyl)phenyl]methanimidamide
CID 54548549
1-(2-ethyl-6-methylphenyl)-2-methylguanidine
CID 62378878
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
(E)-N,N'-bis(2-ethyl-6-methylphenyl)but-2-enediamide
CID 17407260
(E)-N,N'-bis(2,6-diethylphenyl)ethene-1,2-diamine
CID 12975599
1-(2-ethyl-6-methylphenyl)-3-(N'-methylcarbamimidoyl)urea
CID 3049597
(E)-1-(4-chlorophenyl)-3-(2-ethyl-6-methylanilino)prop-2-en-1-one
CID 39346456
N-[(2,6-dichlorophenyl)methyl]-2-ethyl-6-methylaniline
CID 63448215
1-chloro-N-(2-ethyl-6-methylphenyl)methanesulfonamide
CID 63665094
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
N-cyclopentyl-2-ethyl-6-methylaniline
CID 60924694
(Z)-2-cyano-3-(2-ethyl-6-methylanilino)-N-propylprop-2-enamide
CID 108820244

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide (CID 12768124) is N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide is CCc1cccc(C)c1N/C=N/C.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide?
The InChIKey is YOYYFLHGWYSWDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-4-10-7-5-6-9(2)11(10)13-8-12-3/h5-8H,4H2,1-3H3,(H,12,13).
What are the key properties of N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide?
N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide has a molecular weight of 176.26 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-N'-methylmethanimidamide is sourced from PubChem (CID 12768124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).