2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide

C7H14N2O3 — CID 156750692

IUPAC2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide
SMILESCC(O)CNCC(=O)NCC=O
InChIInChI=1S/C7H14N2O3/c1-6(11)4-8-5-7(12)9-2-3-10/h3,6,8,11H,2,4-5H2,1H3,(H,9,12)
InChIKeyVCZWXABXYUUXGI-UHFFFAOYSA-N
MW174.20 g/mol
LogP-1.73
Rot. Bonds6

About 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide

2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide (PubChem CID 156750692) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide
PubChem CID156750692
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide
SMILESCC(O)CNCC(=O)NCC=O
InChIInChI=1S/C7H14N2O3/c1-6(11)4-8-5-7(12)9-2-3-10/h3,6,8,11H,2,4-5H2,1H3,(H,9,12)
InChIKeyVCZWXABXYUUXGI-UHFFFAOYSA-N
XLogP-1.73
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-1.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[(2S)-2-hydroxypropyl]amino]-N-propylacetamide
CID 106931868
N-hydroxy-2-(2-hydroxypropylamino)acetamide
CID 142100619
2-[(4-methyl-1-oxopentan-2-yl)amino]-N-(2-oxoethyl)acetamide
CID 144519376
4-amino-N-(2-oxoethyl)pentanamide
CID 143686044
N-(4-fluorophenyl)-2-(2-hydroxypropylamino)acetamide
CID 43389711
2-amino-N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(2-oxoethylamino)ethyl]amino]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]acetamide
CID 122707091
2-[(2-chloroacetyl)amino]-N-(2-oxoethyl)acetamide
CID 173312497
2-(2-hydroxypropylamino)-N,N-dimethylacetamide
CID 43392843
1-(2-methylpropyl)-3-(2-oxoethyl)urea
CID 117235660
N-[2-(2-hydroxypropylamino)ethyl]prop-2-enamide
CID 104593753
N-[2-(2-hydroxypropylamino)ethyl]butanamide
CID 104593451
2-[[2-(2-methylpropylamino)acetyl]amino]acetic acid
CID 139446842

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide?
The IUPAC name of 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide (CID 156750692) is 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide.
What is the SMILES notation for 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide?
The canonical SMILES for 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide is CC(O)CNCC(=O)NCC=O.
What is the InChIKey of 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide?
The InChIKey is VCZWXABXYUUXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3/c1-6(11)4-8-5-7(12)9-2-3-10/h3,6,8,11H,2,4-5H2,1H3,(H,9,12).
What are the key properties of 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide?
2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide has a molecular weight of 174.20 g/mol, XLogP of -1.73, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropylamino)-N-(2-oxoethyl)acetamide is sourced from PubChem (CID 156750692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).