N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine

C17H22N2O — CID 62553756

IUPACN'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine
SMILESCOc1ccccc1N(C)CCNc1ccc(C)cc1
InChIInChI=1S/C17H22N2O/c1-14-8-10-15(11-9-14)18-12-13-19(2)16-6-4-5-7-17(16)20-3/h4-11,18H,12-13H2,1-3H3
InChIKeyDQONFEXMZZFQBW-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.55
Rot. Bonds6

About N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine

N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine (PubChem CID 62553756) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine
PubChem CID62553756
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine
SMILESCOc1ccccc1N(C)CCNc1ccc(C)cc1
InChIInChI=1S/C17H22N2O/c1-14-8-10-15(11-9-14)18-12-13-19(2)16-6-4-5-7-17(16)20-3/h4-11,18H,12-13H2,1-3H3
InChIKeyDQONFEXMZZFQBW-UHFFFAOYSA-N
XLogP3.55
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(2-methoxyphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 54807142
2-methoxy-N-methyl-N-propylaniline
CID 23198488
N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 62555730
N-(hydrazinylmethyl)-2-methoxy-N-methylaniline
CID 115260697
2-(ethylamino)-4-(2-methoxy-N-methylanilino)-2-methylbutan-1-ol
CID 64791522
N-cyclopentyl-N'-(2-methoxyphenyl)-N'-methylpropane-1,3-diamine
CID 62562030
4-(2-methoxy-N-methylanilino)-2,2-dimethylbutanoic acid
CID 65247680
N'-(3-methoxyphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 54806936
N-(2-cyclopropyl-6,7-dimethoxyquinazolin-4-yl)-N'-(2-methoxyphenyl)-N'-methylethane-1,2-diamine
CID 90248877
2-[4-[(N-(2-hydroxyethylamino)-2-methoxyanilino)methoxy]anilino]ethanol
CID 54552391
N-[(2-methoxyphenyl)methyl]-3-(4-methylanilino)propanamide
CID 109021998
2-(ethylamino)-6-(2-methoxy-N-methylanilino)-2-methylhexan-1-ol
CID 64790716

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine (CID 62553756) is N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine is COc1ccccc1N(C)CCNc1ccc(C)cc1.
What is the InChIKey of N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine?
The InChIKey is DQONFEXMZZFQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-14-8-10-15(11-9-14)18-12-13-19(2)16-6-4-5-7-17(16)20-3/h4-11,18H,12-13H2,1-3H3.
What are the key properties of N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine?
N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine has a molecular weight of 270.38 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 62553756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).