N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide

C7H15N3O3 — CID 58786289

IUPACN-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide
SMILESCNCC(=O)N(CCO)CC(N)=O
InChIInChI=1S/C7H15N3O3/c1-9-4-7(13)10(2-3-11)5-6(8)12/h9,11H,2-5H2,1H3,(H2,8,12)
InChIKeyJHZQZZFNLWZYPL-UHFFFAOYSA-N
MW189.21 g/mol
LogP-2.49
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide

N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide (PubChem CID 58786289) has the molecular formula C7H15N3O3 and a molecular weight of 189.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide
PubChem CID58786289
Molecular FormulaC7H15N3O3
Molecular Weight189.21 g/mol
Exact Mass189.11
IUPAC NameN-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide
SMILESCNCC(=O)N(CCO)CC(N)=O
InChIInChI=1S/C7H15N3O3/c1-9-4-7(13)10(2-3-11)5-6(8)12/h9,11H,2-5H2,1H3,(H2,8,12)
InChIKeyJHZQZZFNLWZYPL-UHFFFAOYSA-N
XLogP-2.49
TPSA95.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 5-2.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)octanamide
CID 177356910
N-(2-amino-2-oxoethyl)-N-benzyl-2-(methylamino)acetamide;hydrochloride
CID 119783026
N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
N-[2-[[2-[[2-[(2-amino-2-oxoethyl)-hexylamino]-2-oxoethyl]-decylamino]-2-oxoethyl]-hexylamino]-2-oxoethyl]-N-decyl-2-(2-hydroxyethylamino)acetamide
CID 176551991
methyl N-[2-[(2-amino-2-oxoethyl)-butylamino]-2-oxoethyl]carbamate
CID 47307690
N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-[(2R)-butan-2-yl]amino]-2-oxoethyl]-[(2R)-butan-2-yl]amino]-2-oxoethyl]-(2-hydroxyethyl)amino]-2-oxoethyl]-(2-hydroxyethyl)amino]-2-oxoethyl]-[(2R)-butan-2-yl]amino]-2-oxoethyl]-[(2R)-butan-2-yl]amino]-2-oxoethyl]-(2-hydroxyethyl)amino]-2-oxoethyl]-(2-hydroxyethyl)amino]-2-oxoethyl]-N-[(2R)-butan-2-yl]-2-[[(2R)-butan-2-yl]amino]acetamide
CID 146637785
3-[2-hydroxyethyl(methylcarbamothioyl)amino]propanamide
CID 4638963
N-(2-amino-2-oxoethyl)-N-propylbutanamide
CID 57237794
2-[bis(2-hydroxyethyl)amino]acetamide;dihydrochloride
CID 18671967
N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-N-methyl-2-(methylamino)acetamide
CID 146638084
N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide
CID 103104212
2-[2-hydroxyethyl(phosphanyl)amino]acetamide
CID 143796096

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide (CID 58786289) is N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide is CNCC(=O)N(CCO)CC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide?
The InChIKey is JHZQZZFNLWZYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O3/c1-9-4-7(13)10(2-3-11)5-6(8)12/h9,11H,2-5H2,1H3,(H2,8,12).
What are the key properties of N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide?
N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide has a molecular weight of 189.21 g/mol, XLogP of -2.49, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-(2-hydroxyethyl)-2-(methylamino)acetamide is sourced from PubChem (CID 58786289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).