3-(2,2-diethoxyethylamino)-2-hydroxypropanamide

C9H20N2O4 — CID 106174370

IUPAC3-(2,2-diethoxyethylamino)-2-hydroxypropanamide
SMILESCCOC(CNCC(O)C(N)=O)OCC
InChIInChI=1S/C9H20N2O4/c1-3-14-8(15-4-2)6-11-5-7(12)9(10)13/h7-8,11-12H,3-6H2,1-2H3,(H2,10,13)
InChIKeyFWWYHXDHFUQBAU-UHFFFAOYSA-N
MW220.27 g/mol
LogP-1.18
Rot. Bonds9

About 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide

3-(2,2-diethoxyethylamino)-2-hydroxypropanamide (PubChem CID 106174370) has the molecular formula C9H20N2O4 and a molecular weight of 220.27 g/mol. Its IUPAC name is 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide.

Molecular Properties

Compound Name3-(2,2-diethoxyethylamino)-2-hydroxypropanamide
PubChem CID106174370
Molecular FormulaC9H20N2O4
Molecular Weight220.27 g/mol
Exact Mass220.14
IUPAC Name3-(2,2-diethoxyethylamino)-2-hydroxypropanamide
SMILESCCOC(CNCC(O)C(N)=O)OCC
InChIInChI=1S/C9H20N2O4/c1-3-14-8(15-4-2)6-11-5-7(12)9(10)13/h7-8,11-12H,3-6H2,1-2H3,(H2,10,13)
InChIKeyFWWYHXDHFUQBAU-UHFFFAOYSA-N
XLogP-1.18
TPSA93.81 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 5-1.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(2,2-dimethoxyethylamino)-2-hydroxypropanamide
CID 106170441
3-[(3-ethoxy-2-hydroxypropyl)amino]-2-hydroxypropanamide
CID 106174560
2-hydroxy-3-[[(2R)-2-hydroxypropyl]amino]propanamide
CID 106174936
3-[[3-(2-ethoxyethoxy)-2-hydroxypropyl]amino]-2-hydroxypropanamide
CID 106174317
ethyl 2-[[(3-amino-2-hydroxy-3-oxopropyl)amino]methyl]prop-2-enoate
CID 106178121
2-hydroxy-3-(2-methoxyethylamino)propanamide
CID 106174482
3-(2-ethylsulfonylethylamino)-2-hydroxypropanamide
CID 106174934
3-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-2-hydroxypropanamide
CID 106174842
1-cyclopropyl-2-(2,2-diethoxyethylamino)ethanol
CID 81094787
2-(3,3-diethoxypropylamino)propanamide
CID 81095052
4-(2,2-diethoxyethylamino)butan-1-ol
CID 106841702
4-[(3-amino-2-hydroxy-3-oxopropyl)amino]-3-hydroxybutanoic acid
CID 106178077

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide?
The IUPAC name of 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide (CID 106174370) is 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide.
What is the SMILES notation for 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide?
The canonical SMILES for 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide is CCOC(CNCC(O)C(N)=O)OCC.
What is the InChIKey of 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide?
The InChIKey is FWWYHXDHFUQBAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O4/c1-3-14-8(15-4-2)6-11-5-7(12)9(10)13/h7-8,11-12H,3-6H2,1-2H3,(H2,10,13).
What are the key properties of 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide?
3-(2,2-diethoxyethylamino)-2-hydroxypropanamide has a molecular weight of 220.27 g/mol, XLogP of -1.18, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-diethoxyethylamino)-2-hydroxypropanamide is sourced from PubChem (CID 106174370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).