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

C17H22N2O — CID 57024547

IUPACN'-(2-benzhydryloxyethyl)ethane-1,2-diamine
SMILESNCCNCCOC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H22N2O/c18-11-12-19-13-14-20-17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17,19H,11-14,18H2
InChIKeyIGOJSVYFYTVXSG-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.34
Rot. Bonds8

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

N'-(2-benzhydryloxyethyl)ethane-1,2-diamine (PubChem CID 57024547) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N'-(2-benzhydryloxyethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-benzhydryloxyethyl)ethane-1,2-diamine
PubChem CID57024547
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN'-(2-benzhydryloxyethyl)ethane-1,2-diamine
SMILESNCCNCCOC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H22N2O/c18-11-12-19-13-14-20-17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17,19H,11-14,18H2
InChIKeyIGOJSVYFYTVXSG-UHFFFAOYSA-N
XLogP2.34
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-[2-[(4-tert-butylphenyl)-phenylmethoxy]ethyl]ethane-1,2-diamine
CID 171986728
1-N-(2-benzhydryloxyethyl)pentane-1,4-diamine
CID 57070167
N-(3-benzhydryloxypropyl)-3-phenylpropan-1-amine
CID 86174020
(2R)-1-(2-benzhydryloxyethylamino)propan-2-ol
CID 97355382
3-(4-methylphenyl)-N-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]propan-1-amine
CID 121338178
N-(2-benzhydryloxyethyl)-2-phenoxyethanamine;oxalic acid
CID 155529314
N'-[2-[bis(4-fluorophenyl)methoxy]ethyl]-N-(2-phenylethyl)propane-1,3-diamine
CID 10788465
[2-[2-[2-(2-benzhydryloxyethylamino)ethylsulfanylsulfonyloxy]ethylamino]ethoxy-phenylmethyl]benzene
CID 21128167
3-benzhydryloxy-N-propan-2-ylpropan-1-amine
CID 163865412
3-benzhydryloxypropylbenzene
CID 11255103
3-(2-benzhydryloxyethylamino)-1-(3,4-dimethylphenyl)propan-1-one
CID 110177605
N'-(2-phenylsulfanylethyl)ethane-1,2-diamine;dihydrochloride
CID 11708797

Frequently Asked Questions

What is the IUPAC name of N'-(2-benzhydryloxyethyl)ethane-1,2-diamine?
The IUPAC name of N'-(2-benzhydryloxyethyl)ethane-1,2-diamine (CID 57024547) is N'-(2-benzhydryloxyethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-benzhydryloxyethyl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-benzhydryloxyethyl)ethane-1,2-diamine is NCCNCCOC(c1ccccc1)c1ccccc1.
What is the InChIKey of N'-(2-benzhydryloxyethyl)ethane-1,2-diamine?
The InChIKey is IGOJSVYFYTVXSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c18-11-12-19-13-14-20-17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17,19H,11-14,18H2.
What are the key properties of N'-(2-benzhydryloxyethyl)ethane-1,2-diamine?
N'-(2-benzhydryloxyethyl)ethane-1,2-diamine has a molecular weight of 270.38 g/mol, XLogP of 2.34, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-benzhydryloxyethyl)ethane-1,2-diamine is sourced from PubChem (CID 57024547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).