ethane-1,2-diamine;hydron

C2H9N2+ — CID 175410368

IUPACethane-1,2-diamine;hydron
SMILESNCCN.[H+]
InChIInChI=1S/C2H8N2/c3-1-2-4/h1-4H2/p+1
InChIKeyPIICEJLVQHRZGT-UHFFFAOYSA-O
MW61.11 g/mol
LogP-0.98
Rot. Bonds1

About ethane-1,2-diamine;hydron

ethane-1,2-diamine;hydron (PubChem CID 175410368) has the molecular formula C2H9N2+ and a molecular weight of 61.11 g/mol. Its IUPAC name is ethane-1,2-diamine;hydron.

Molecular Properties

Compound Nameethane-1,2-diamine;hydron
PubChem CID175410368
Molecular FormulaC2H9N2+
Molecular Weight61.11 g/mol
Exact Mass61.08
IUPAC Nameethane-1,2-diamine;hydron
SMILESNCCN.[H+]
InChIInChI=1S/C2H8N2/c3-1-2-4/h1-4H2/p+1
InChIKeyPIICEJLVQHRZGT-UHFFFAOYSA-O
XLogP-0.98
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50061.11
LogP ≤ 5-0.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 158052826
CID 159340027
CID 159340027
zinc;ethane-1,2-diamine;sulfide
CID 162247318
ethane-1,2-diamine;platinum;hydrochloride
CID 87835544
tetrakis(ethane-1,2-diamine);palladium(2+);dichloride
CID 173374677
bis(ethane-1,2-diamine);palladium(2+);chloride
CID 170920829
ethane;ethane-1,2-diamine;dihydrochloride
CID 168908211
2-(2-aminoethoxy)ethanamine;hydron;dichloride
CID 74764781

Frequently Asked Questions

What is the IUPAC name of ethane-1,2-diamine;hydron?
The IUPAC name of ethane-1,2-diamine;hydron (CID 175410368) is ethane-1,2-diamine;hydron.
What is the SMILES notation for ethane-1,2-diamine;hydron?
The canonical SMILES for ethane-1,2-diamine;hydron is NCCN.[H+].
What is the InChIKey of ethane-1,2-diamine;hydron?
The InChIKey is PIICEJLVQHRZGT-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H8N2/c3-1-2-4/h1-4H2/p+1.
What are the key properties of ethane-1,2-diamine;hydron?
ethane-1,2-diamine;hydron has a molecular weight of 61.11 g/mol, XLogP of -0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane-1,2-diamine;hydron is sourced from PubChem (CID 175410368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).