N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide

C16H18N2 — CID 71332209

IUPACN-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide
SMILESC/C(=N\c1ccc(C)cc1)N(C)c1ccccc1
InChIInChI=1S/C16H18N2/c1-13-9-11-15(12-10-13)17-14(2)18(3)16-7-5-4-6-8-16/h4-12H,1-3H3/b17-14+
InChIKeyWQSBOARAGZECDH-SAPNQHFASA-N
MW238.33 g/mol
LogP4.18
Rot. Bonds2

About N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide

N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide (PubChem CID 71332209) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide.

Molecular Properties

Compound NameN-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide
PubChem CID71332209
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC NameN-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide
SMILESC/C(=N\c1ccc(C)cc1)N(C)c1ccccc1
InChIInChI=1S/C16H18N2/c1-13-9-11-15(12-10-13)17-14(2)18(3)16-7-5-4-6-8-16/h4-12H,1-3H3/b17-14+
InChIKeyWQSBOARAGZECDH-SAPNQHFASA-N
XLogP4.18
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.18
H-Bond Donors ≤ 50
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-hydroxy-N,N'-bis(4-methylphenyl)ethanimidamide
CID 71372467
N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide
CID 4779367
benzene;N,4-dimethyl-N-phenylaniline
CID 71196716
N-(dimethylaminomethylidene)-N'-(4-methylphenyl)benzenecarboximidamide
CID 10912424
methyl N-[2-(N-benzoyl-4-methylanilino)-1,2-bis(N-methylanilino)ethenyl]-N-(4-methylphenyl)-N'-phenylcarbamimidothioate
CID 85028100
N-methyl-N-phenylaniline;1-methyl-4-(4-phenylphenyl)benzene;1-methyl-4-[4-(4-phenylphenyl)phenyl]benzene;1-methyl-4-[4-[4-(4-phenylphenyl)phenyl]phenyl]benzene
CID 157193805
N,4-dimethyl-N-phenylaniline;ethane;toluene
CID 143203824
1-methyl-2-(4-methylphenyl)sulfonyl-1-phenylguanidine
CID 67176300
1,3-dimethyl-1,3-diphenylselenourea
CID 12787621
ethane;tris(4-methyl-N,N-diphenylaniline)
CID 159159918
hydroxysilane;toluene
CID 174524422
N,N'-dimethyl-N-phenylpropanimidamide
CID 155020037

Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide?
The IUPAC name of N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide (CID 71332209) is N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide.
What is the SMILES notation for N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide?
The canonical SMILES for N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide is C/C(=N\c1ccc(C)cc1)N(C)c1ccccc1.
What is the InChIKey of N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide?
The InChIKey is WQSBOARAGZECDH-SAPNQHFASA-N. The full InChI is InChI=1S/C16H18N2/c1-13-9-11-15(12-10-13)17-14(2)18(3)16-7-5-4-6-8-16/h4-12H,1-3H3/b17-14+.
What are the key properties of N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide?
N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide has a molecular weight of 238.33 g/mol, XLogP of 4.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-(4-methylphenyl)-N-phenylethanimidamide is sourced from PubChem (CID 71332209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).