N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione

C10H23N5O2 — CID 19064334

IUPACN'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione
SMILESNCCNCCNCCN.O=C1CCC(=O)N1
InChIInChI=1S/C6H18N4.C4H5NO2/c7-1-3-9-5-6-10-4-2-8;6-3-1-2-4(7)5-3/h9-10H,1-8H2;1-2H2,(H,5,6,7)
InChIKeyMDHGUFGLYYOUSW-UHFFFAOYSA-N
MW245.33 g/mol
LogP-2.49
Rot. Bonds7

About N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione

N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione (PubChem CID 19064334) has the molecular formula C10H23N5O2 and a molecular weight of 245.33 g/mol. Its IUPAC name is N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione.

Molecular Properties

Compound NameN'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione
PubChem CID19064334
Molecular FormulaC10H23N5O2
Molecular Weight245.33 g/mol
Exact Mass245.19
IUPAC NameN'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione
SMILESNCCNCCNCCN.O=C1CCC(=O)N1
InChIInChI=1S/C6H18N4.C4H5NO2/c7-1-3-9-5-6-10-4-2-8;6-3-1-2-4(7)5-3/h9-10H,1-8H2;1-2H2,(H,5,6,7)
InChIKeyMDHGUFGLYYOUSW-UHFFFAOYSA-N
XLogP-2.49
TPSA122.27 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 5-2.49
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione?
The IUPAC name of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione (CID 19064334) is N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione.
What is the SMILES notation for N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione?
The canonical SMILES for N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione is NCCNCCNCCN.O=C1CCC(=O)N1.
What is the InChIKey of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione?
The InChIKey is MDHGUFGLYYOUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N4.C4H5NO2/c7-1-3-9-5-6-10-4-2-8;6-3-1-2-4(7)5-3/h9-10H,1-8H2;1-2H2,(H,5,6,7).
What are the key properties of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione?
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione has a molecular weight of 245.33 g/mol, XLogP of -2.49, 7 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione is sourced from PubChem (CID 19064334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).