N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine

C4H15N5 — CID 19014018

IUPACN'-[2-(diaminoamino)ethyl]ethane-1,2-diamine
SMILESNCCNCCN(N)N
InChIInChI=1S/C4H15N5/c5-1-2-8-3-4-9(6)7/h8H,1-7H2
InChIKeyRNBMWXMEPMHJOL-UHFFFAOYSA-N
MW133.20 g/mol
LogP-2.42
Rot. Bonds5

About N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine

N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine (PubChem CID 19014018) has the molecular formula C4H15N5 and a molecular weight of 133.20 g/mol. Its IUPAC name is N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-(diaminoamino)ethyl]ethane-1,2-diamine
PubChem CID19014018
Molecular FormulaC4H15N5
Molecular Weight133.20 g/mol
Exact Mass133.13
IUPAC NameN'-[2-(diaminoamino)ethyl]ethane-1,2-diamine
SMILESNCCNCCN(N)N
InChIInChI=1S/C4H15N5/c5-1-2-8-3-4-9(6)7/h8H,1-7H2
InChIKeyRNBMWXMEPMHJOL-UHFFFAOYSA-N
XLogP-2.42
TPSA93.33 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.20
LogP ≤ 5-2.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine?
The IUPAC name of N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine (CID 19014018) is N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine is NCCNCCN(N)N.
What is the InChIKey of N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine?
The InChIKey is RNBMWXMEPMHJOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H15N5/c5-1-2-8-3-4-9(6)7/h8H,1-7H2.
What are the key properties of N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine?
N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine has a molecular weight of 133.20 g/mol, XLogP of -2.42, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(diaminoamino)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 19014018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).