2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide

C8H21N5O — CID 57107156

IUPAC2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide
SMILESNCCNCCNCCNCC(N)=O
InChIInChI=1S/C8H21N5O/c9-1-2-11-3-4-12-5-6-13-7-8(10)14/h11-13H,1-7,9H2,(H2,10,14)
InChIKeyHRHQIQZEQJEGRU-UHFFFAOYSA-N
MW203.29 g/mol
LogP-2.80
Rot. Bonds10

About 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide

2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide (PubChem CID 57107156) has the molecular formula C8H21N5O and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide.

Molecular Properties

Compound Name2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide
PubChem CID57107156
Molecular FormulaC8H21N5O
Molecular Weight203.29 g/mol
Exact Mass203.17
IUPAC Name2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide
SMILESNCCNCCNCCNCC(N)=O
InChIInChI=1S/C8H21N5O/c9-1-2-11-3-4-12-5-6-13-7-8(10)14/h11-13H,1-7,9H2,(H2,10,14)
InChIKeyHRHQIQZEQJEGRU-UHFFFAOYSA-N
XLogP-2.80
TPSA105.20 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 5-2.80
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(3-aminopropylamino)acetamide
CID 59908103
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;carbamic acid
CID 158173045
acetamide;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 140516466
N,N'-bis[2-(2-aminoethylamino)ethyl]propanediamide
CID 100925313
N,N'-bis[2-[2-(2-aminoethylamino)ethylamino]ethyl]propanediamide
CID 59846980
2-[2-(2-aminoethylamino)ethylamino]ethylurea
CID 175595434
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine
CID 159410169
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 5565
acetic acid;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine
CID 159794226
acetic acid;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 30081
2-(propylamino)acetamide
CID 15839438
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;pentahydrochloride
CID 10150970

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide?
The IUPAC name of 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide (CID 57107156) is 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide.
What is the SMILES notation for 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide?
The canonical SMILES for 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide is NCCNCCNCCNCC(N)=O.
What is the InChIKey of 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide?
The InChIKey is HRHQIQZEQJEGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N5O/c9-1-2-11-3-4-12-5-6-13-7-8(10)14/h11-13H,1-7,9H2,(H2,10,14).
What are the key properties of 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide?
2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide has a molecular weight of 203.29 g/mol, XLogP of -2.80, 10 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]acetamide is sourced from PubChem (CID 57107156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).