N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine

C19H26N2O — CID 10732853

IUPACN'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)CCOC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H26N2O/c1-20-13-14-21(2)15-16-22-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19-20H,13-16H2,1-2H3
InChIKeyVAIUDQXXZGHICS-UHFFFAOYSA-N
MW298.43 g/mol
LogP2.94
Rot. Bonds9

About N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine

N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine (PubChem CID 10732853) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine
PubChem CID10732853
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC NameN'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)CCOC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H26N2O/c1-20-13-14-21(2)15-16-22-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19-20H,13-16H2,1-2H3
InChIKeyVAIUDQXXZGHICS-UHFFFAOYSA-N
XLogP2.94
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine (CID 10732853) is N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine is CNCCN(C)CCOC(c1ccccc1)c1ccccc1.
What is the InChIKey of N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine?
The InChIKey is VAIUDQXXZGHICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-20-13-14-21(2)15-16-22-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19-20H,13-16H2,1-2H3.
What are the key properties of N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine?
N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine has a molecular weight of 298.43 g/mol, XLogP of 2.94, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-benzhydryloxyethyl)-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 10732853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).