N',N'-dibenzylethane-1,2-diamine;ethenamine

C18H25N3 — CID 67896793

IUPACN',N'-dibenzylethane-1,2-diamine;ethenamine
SMILESC=CN.NCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C16H20N2.C2H5N/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;1-2-3/h1-10H,11-14,17H2;2H,1,3H2
InChIKeyXYYWEJOZGWWOOY-UHFFFAOYSA-N
MW283.42 g/mol
LogP2.74
Rot. Bonds6

About N',N'-dibenzylethane-1,2-diamine;ethenamine

N',N'-dibenzylethane-1,2-diamine;ethenamine (PubChem CID 67896793) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N',N'-dibenzylethane-1,2-diamine;ethenamine.

Molecular Properties

Compound NameN',N'-dibenzylethane-1,2-diamine;ethenamine
PubChem CID67896793
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN',N'-dibenzylethane-1,2-diamine;ethenamine
SMILESC=CN.NCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C16H20N2.C2H5N/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;1-2-3/h1-10H,11-14,17H2;2H,1,3H2
InChIKeyXYYWEJOZGWWOOY-UHFFFAOYSA-N
XLogP2.74
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N',N'-dibenzylethane-1,2-diamine;hydrochloride
CID 6460674
2-[2-aminoethyl(benzyl)amino]-N,N-bis(prop-2-enyl)acetamide
CID 104694105
N'-benzyl-N'-[(Z)-2,3-dichloroprop-2-enyl]ethane-1,2-diamine
CID 106511612
N'-benzyl-N'-[(3-methylphenyl)methyl]ethane-1,2-diamine
CID 39357118
N'-benzyl-N'-hexadecylethane-1,2-diamine
CID 22067437
N'-benzyl-N'-[(2,4-difluorophenyl)methyl]ethane-1,2-diamine
CID 62197006
N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine
CID 122164959
N'-benzyl-N'-(2,2-diphenylethyl)ethane-1,2-diamine
CID 23995073
N'-benzyl-N'-but-3-enylpropane-1,3-diamine
CID 107367467
N'-(1-benzofuran-3-ylmethyl)-N'-benzylethane-1,2-diamine
CID 104869951
N'-[2-[2-aminoethyl(benzyl)amino]ethyl]ethane-1,2-diamine
CID 101461919
N,N-dibenzylpropan-1-amine
CID 10840212

Frequently Asked Questions

What is the IUPAC name of N',N'-dibenzylethane-1,2-diamine;ethenamine?
The IUPAC name of N',N'-dibenzylethane-1,2-diamine;ethenamine (CID 67896793) is N',N'-dibenzylethane-1,2-diamine;ethenamine.
What is the SMILES notation for N',N'-dibenzylethane-1,2-diamine;ethenamine?
The canonical SMILES for N',N'-dibenzylethane-1,2-diamine;ethenamine is C=CN.NCCN(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N',N'-dibenzylethane-1,2-diamine;ethenamine?
The InChIKey is XYYWEJOZGWWOOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2.C2H5N/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;1-2-3/h1-10H,11-14,17H2;2H,1,3H2.
What are the key properties of N',N'-dibenzylethane-1,2-diamine;ethenamine?
N',N'-dibenzylethane-1,2-diamine;ethenamine has a molecular weight of 283.42 g/mol, XLogP of 2.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dibenzylethane-1,2-diamine;ethenamine is sourced from PubChem (CID 67896793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).