2-ethoxy-2-hydroxypropanediamide

C5H10N2O4 — CID 45122517

IUPAC2-ethoxy-2-hydroxypropanediamide
SMILESCCOC(O)(C(N)=O)C(N)=O
InChIInChI=1S/C5H10N2O4/c1-2-11-5(10,3(6)8)4(7)9/h10H,2H2,1H3,(H2,6,8)(H2,7,9)
InChIKeyZVHQMTAQSUXEKC-UHFFFAOYSA-N
MW162.15 g/mol
LogP-2.32
Rot. Bonds4

About 2-ethoxy-2-hydroxypropanediamide

2-ethoxy-2-hydroxypropanediamide (PubChem CID 45122517) has the molecular formula C5H10N2O4 and a molecular weight of 162.15 g/mol. Its IUPAC name is 2-ethoxy-2-hydroxypropanediamide.

Molecular Properties

Compound Name2-ethoxy-2-hydroxypropanediamide
PubChem CID45122517
Molecular FormulaC5H10N2O4
Molecular Weight162.15 g/mol
Exact Mass162.06
IUPAC Name2-ethoxy-2-hydroxypropanediamide
SMILESCCOC(O)(C(N)=O)C(N)=O
InChIInChI=1S/C5H10N2O4/c1-2-11-5(10,3(6)8)4(7)9/h10H,2H2,1H3,(H2,6,8)(H2,7,9)
InChIKeyZVHQMTAQSUXEKC-UHFFFAOYSA-N
XLogP-2.32
TPSA115.64 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.15
LogP ≤ 5-2.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-ethoxy-2-hydroxypropanediamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethoxy-2,3,3,3-tetrafluoropropanamide
CID 2802176
1,3-diamino-2-ethoxypropan-2-ol
CID 174780599
bis(2-methylpropyl) 2,3-diethoxy-2,3-dimethylbutanedioate
CID 139989397
2,2-dihydroxybutanamide
CID 22465138
acetic acid;triethoxymethanamine
CID 175078602
ethyl 3-hydroxy-2-methyl-4-[(2-methylpropan-2-yl)oxy]butanoate
CID 546410
diethyl 2,3-diethoxy-2,3-diethylbutanedioate
CID 139989312
ethyl carbamate
CID 161409576
ethyl carbamate
CID 21202847
ethyl carbamate
CID 158786750
1,1,1-triethoxypropan-2-ol
CID 87156976
diethyl 2,2,3,3-tetrahydroxybutanedioate
CID 11264895

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-hydroxypropanediamide?
The IUPAC name of 2-ethoxy-2-hydroxypropanediamide (CID 45122517) is 2-ethoxy-2-hydroxypropanediamide.
What is the SMILES notation for 2-ethoxy-2-hydroxypropanediamide?
The canonical SMILES for 2-ethoxy-2-hydroxypropanediamide is CCOC(O)(C(N)=O)C(N)=O.
What is the InChIKey of 2-ethoxy-2-hydroxypropanediamide?
The InChIKey is ZVHQMTAQSUXEKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O4/c1-2-11-5(10,3(6)8)4(7)9/h10H,2H2,1H3,(H2,6,8)(H2,7,9).
What are the key properties of 2-ethoxy-2-hydroxypropanediamide?
2-ethoxy-2-hydroxypropanediamide has a molecular weight of 162.15 g/mol, XLogP of -2.32, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-hydroxypropanediamide is sourced from PubChem (CID 45122517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).