N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide

C16H18N2O — CID 20660876

IUPACN-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide
SMILESCOc1ccccc1N/C(C)=N/c1ccccc1C
InChIInChI=1S/C16H18N2O/c1-12-8-4-5-9-14(12)17-13(2)18-15-10-6-7-11-16(15)19-3/h4-11H,1-3H3,(H,17,18)
InChIKeyYGNUKJAFHSOIHH-UHFFFAOYSA-N
MW254.33 g/mol
LogP4.17
Rot. Bonds3

About N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide

N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide (PubChem CID 20660876) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide
PubChem CID20660876
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide
SMILESCOc1ccccc1N/C(C)=N/c1ccccc1C
InChIInChI=1S/C16H18N2O/c1-12-8-4-5-9-14(12)17-13(2)18-15-10-6-7-11-16(15)19-3/h4-11H,1-3H3,(H,17,18)
InChIKeyYGNUKJAFHSOIHH-UHFFFAOYSA-N
XLogP4.17
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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'-(2-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 2223435
3-(2-methoxyphenyl)-1,1-dimethylurea
CID 4216204
ethane;(2-methoxyphenyl)urea
CID 143063924
1-(2-methoxyphenyl)-3-[3-(2-methylphenoxy)propyl]urea
CID 108883704
2-methoxy-N-[(3E)-5,5,5-trifluoro-4-methylpenta-1,3-dien-2-yl]aniline
CID 142147298
methyl 3-(2-methylphenyl)iminobutanoate
CID 54292999
(Z)-4-(2-methoxyanilino)pent-3-en-2-one
CID 102222000
N-(2-methoxyphenyl)-3-methylbut-2-enamide
CID 19177446
1-amino-3-(2-methoxyphenyl)-2-methylguanidine
CID 116510612
tripropan-2-yl 3-N-(2-methoxyphenyl)-1-N,5-N-bis(2-methylphenyl)benzene-1,3,5-tricarboximidate
CID 122577767
ethyl (2E)-2-hydroxyimino-3-(2-methoxyanilino)-3-oxopropanoate
CID 6416707
N-(3-chloro-2-methylphenyl)-N'-(2-methoxyphenyl)oxamide
CID 45000336

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide?
The IUPAC name of N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide (CID 20660876) is N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide?
The canonical SMILES for N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide is COc1ccccc1N/C(C)=N/c1ccccc1C.
What is the InChIKey of N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide?
The InChIKey is YGNUKJAFHSOIHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-8-4-5-9-14(12)17-13(2)18-15-10-6-7-11-16(15)19-3/h4-11H,1-3H3,(H,17,18).
What are the key properties of N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide?
N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide has a molecular weight of 254.33 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N'-(2-methylphenyl)ethanimidamide is sourced from PubChem (CID 20660876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).