2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide

C14H28N8O5 — CID 10134862

IUPAC2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide
SMILESNC(=O)CN(CCN(CC(N)=O)CC(N)=O)CCN(CC(N)=O)CC(N)=O
InChIInChI=1S/C14H28N8O5/c15-10(23)5-20(1-3-21(6-11(16)24)7-12(17)25)2-4-22(8-13(18)26)9-14(19)27/h1-9H2,(H2,15,23)(H2,16,24)(H2,17,25)(H2,18,26)(H2,19,27)
InChIKeyRAEIIDYNDAXHDS-UHFFFAOYSA-N
MW388.43 g/mol
LogP-5.68
Rot. Bonds16

About 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide

2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide (PubChem CID 10134862) has the molecular formula C14H28N8O5 and a molecular weight of 388.43 g/mol. Its IUPAC name is 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide.

Molecular Properties

Compound Name2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide
PubChem CID10134862
Molecular FormulaC14H28N8O5
Molecular Weight388.43 g/mol
Exact Mass388.22
IUPAC Name2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide
SMILESNC(=O)CN(CCN(CC(N)=O)CC(N)=O)CCN(CC(N)=O)CC(N)=O
InChIInChI=1S/C14H28N8O5/c15-10(23)5-20(1-3-21(6-11(16)24)7-12(17)25)2-4-22(8-13(18)26)9-14(19)27/h1-9H2,(H2,15,23)(H2,16,24)(H2,17,25)(H2,18,26)(H2,19,27)
InChIKeyRAEIIDYNDAXHDS-UHFFFAOYSA-N
XLogP-5.68
TPSA225.17 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 5-5.68
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

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Related Compounds

2-[bis(2-hydroxyethyl)amino]acetamide;dihydrochloride
CID 18671967
2-[2-[(2-amino-2-oxoethyl)-(carboxymethyl)amino]ethyl-(2-nitrosoethyl)amino]acetic acid
CID 139393080
2-[2-hydroxyethyl(3-hydroxypropyl)amino]acetamide
CID 90229971
2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;carbamic acid
CID 146494251
2-[(2-amino-2-oxoethyl)-(5-oxohexyl)amino]acetamide
CID 62921718
2-[(2-amino-2-oxoethyl)-(3-aminopropyl)amino]acetic acid
CID 107440465
2-[2-[(2-amino-2-oxoethyl)-butylamino]ethyl-[2-[(2-amino-2-oxoethyl)-propylamino]ethyl]amino]acetic acid
CID 153111880
2-[(4-amino-3,3-dimethylbutyl)-(2-amino-2-oxoethyl)amino]acetamide
CID 65246887
2-[2-[(2-amino-2-oxoethyl)-[2-[(2-amino-2-oxoethyl)-[2-(2-oxopropylamino)ethyl]amino]ethyl]amino]ethylamino]acetamide
CID 174307895
2-[2-[2-[(2-amino-2-oxoethyl)-(carboxymethyl)amino]ethyl-(carboxymethyl)amino]ethyl-(3-cyclononylpropyl)amino]acetic acid
CID 126603056
2-[3-(diethylamino)propyl-ethylamino]acetamide
CID 102996272
Ca-DTPA
CID 86735184

Frequently Asked Questions

What is the IUPAC name of 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide?
The IUPAC name of 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide (CID 10134862) is 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide.
What is the SMILES notation for 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide?
The canonical SMILES for 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide is NC(=O)CN(CCN(CC(N)=O)CC(N)=O)CCN(CC(N)=O)CC(N)=O.
What is the InChIKey of 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide?
The InChIKey is RAEIIDYNDAXHDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N8O5/c15-10(23)5-20(1-3-21(6-11(16)24)7-12(17)25)2-4-22(8-13(18)26)9-14(19)27/h1-9H2,(H2,15,23)(H2,16,24)(H2,17,25)(H2,18,26)(H2,19,27).
What are the key properties of 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide?
2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide has a molecular weight of 388.43 g/mol, XLogP of -5.68, 16 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis[2-[bis(2-amino-2-oxoethyl)amino]ethyl]amino]acetamide is sourced from PubChem (CID 10134862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).