N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine

C19H26N2 — CID 65488464

IUPACN'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine
SMILESCCNCC(c1ccccc1)N(C)CCc1ccccc1
InChIInChI=1S/C19H26N2/c1-3-20-16-19(18-12-8-5-9-13-18)21(2)15-14-17-10-6-4-7-11-17/h4-13,19-20H,3,14-16H2,1-2H3
InChIKeyCLJSJZRFKGIJOV-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.51
Rot. Bonds8

About N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine

N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine (PubChem CID 65488464) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine
PubChem CID65488464
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine
SMILESCCNCC(c1ccccc1)N(C)CCc1ccccc1
InChIInChI=1S/C19H26N2/c1-3-20-16-19(18-12-8-5-9-13-18)21(2)15-14-17-10-6-4-7-11-17/h4-13,19-20H,3,14-16H2,1-2H3
InChIKeyCLJSJZRFKGIJOV-UHFFFAOYSA-N
XLogP3.51
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-ethyl-N-methyl-N-(3-methylbutyl)-1-phenylethane-1,2-diamine
CID 55072043
N-[(4-chlorophenyl)methyl]-N'-ethyl-N-methyl-1-phenylethane-1,2-diamine
CID 62413056
N'-ethyl-1-phenyl-N,N-dipropylethane-1,2-diamine
CID 62425629
N,N'-diethyl-1-phenyl-N-propylethane-1,2-diamine
CID 55074782
N-(cyclopentylmethyl)-N'-ethyl-N-methyl-1-phenylethane-1,2-diamine
CID 63655923
N,N'-dimethyl-1-phenyl-N-propylethane-1,2-diamine
CID 62417944
N-butyl-N-methyl-N'-(2-methylpropyl)-1-phenylethane-1,2-diamine
CID 55070032
N-ethyl-2,4-diphenylbutan-1-amine
CID 81024071
2-N-methyl-1-phenyl-2-N-(2-phenylethyl)butane-1,2-diamine
CID 65487407
2-N-methyl-1-phenyl-2-N-(2-phenylethyl)propane-1,2-diamine
CID 65486259
N-ethyl-N-methyl-1-phenyl-N'-propylethane-1,2-diamine
CID 62419505
N'-(ethylsulfamoyl)-N,N-dimethyl-1-phenylethane-1,2-diamine
CID 110620930

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine (CID 65488464) is N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine is CCNCC(c1ccccc1)N(C)CCc1ccccc1.
What is the InChIKey of N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine?
The InChIKey is CLJSJZRFKGIJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-3-20-16-19(18-12-8-5-9-13-18)21(2)15-14-17-10-6-4-7-11-17/h4-13,19-20H,3,14-16H2,1-2H3.
What are the key properties of N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine?
N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine has a molecular weight of 282.43 g/mol, XLogP of 3.51, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-methyl-1-phenyl-N-(2-phenylethyl)ethane-1,2-diamine is sourced from PubChem (CID 65488464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).