N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide

C9H19N3O4 — CID 22892556

IUPACN-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide
SMILESCN(CC(=O)NCCO)CC(=O)NCCO
InChIInChI=1S/C9H19N3O4/c1-12(6-8(15)10-2-4-13)7-9(16)11-3-5-14/h13-14H,2-7H2,1H3,(H,10,15)(H,11,16)
InChIKeyMRJZRRWGMMLWOZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP-2.86
Rot. Bonds8

About N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide

N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide (PubChem CID 22892556) has the molecular formula C9H19N3O4 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide
PubChem CID22892556
Molecular FormulaC9H19N3O4
Molecular Weight233.27 g/mol
Exact Mass233.14
IUPAC NameN-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide
SMILESCN(CC(=O)NCCO)CC(=O)NCCO
InChIInChI=1S/C9H19N3O4/c1-12(6-8(15)10-2-4-13)7-9(16)11-3-5-14/h13-14H,2-7H2,1H3,(H,10,15)(H,11,16)
InChIKeyMRJZRRWGMMLWOZ-UHFFFAOYSA-N
XLogP-2.86
TPSA101.90 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 5-2.86
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide (CID 22892556) is N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide is CN(CC(=O)NCCO)CC(=O)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide?
The InChIKey is MRJZRRWGMMLWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O4/c1-12(6-8(15)10-2-4-13)7-9(16)11-3-5-14/h13-14H,2-7H2,1H3,(H,10,15)(H,11,16).
What are the key properties of N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide?
N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide has a molecular weight of 233.27 g/mol, XLogP of -2.86, 8 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]-methylamino]acetamide is sourced from PubChem (CID 22892556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).