N',N'-dihydroxyethane-1,2-diamine

C2H8N2O2 — CID 18386450

IUPACN',N'-dihydroxyethane-1,2-diamine
SMILESNCCN(O)O
InChIInChI=1S/C2H8N2O2/c3-1-2-4(5)6/h5-6H,1-3H2
InChIKeyVPPZZYUKSCTNNZ-UHFFFAOYSA-N
MW92.10 g/mol
LogP-0.97
Rot. Bonds2

About N',N'-dihydroxyethane-1,2-diamine

N',N'-dihydroxyethane-1,2-diamine (PubChem CID 18386450) has the molecular formula C2H8N2O2 and a molecular weight of 92.10 g/mol. Its IUPAC name is N',N'-dihydroxyethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dihydroxyethane-1,2-diamine
PubChem CID18386450
Molecular FormulaC2H8N2O2
Molecular Weight92.10 g/mol
Exact Mass92.06
IUPAC NameN',N'-dihydroxyethane-1,2-diamine
SMILESNCCN(O)O
InChIInChI=1S/C2H8N2O2/c3-1-2-4(5)6/h5-6H,1-3H2
InChIKeyVPPZZYUKSCTNNZ-UHFFFAOYSA-N
XLogP-0.97
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.10
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N',N'-dihydroxyethane-1,2-diamine?
The IUPAC name of N',N'-dihydroxyethane-1,2-diamine (CID 18386450) is N',N'-dihydroxyethane-1,2-diamine.
What is the SMILES notation for N',N'-dihydroxyethane-1,2-diamine?
The canonical SMILES for N',N'-dihydroxyethane-1,2-diamine is NCCN(O)O.
What is the InChIKey of N',N'-dihydroxyethane-1,2-diamine?
The InChIKey is VPPZZYUKSCTNNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2O2/c3-1-2-4(5)6/h5-6H,1-3H2.
What are the key properties of N',N'-dihydroxyethane-1,2-diamine?
N',N'-dihydroxyethane-1,2-diamine has a molecular weight of 92.10 g/mol, XLogP of -0.97, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dihydroxyethane-1,2-diamine is sourced from PubChem (CID 18386450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).