N-ethyl-N-(hydroxymethyl)propanamide

C6H13NO2 — CID 18715922

IUPACN-ethyl-N-(hydroxymethyl)propanamide
SMILESCCC(=O)N(CC)CO
InChIInChI=1S/C6H13NO2/c1-3-6(9)7(4-2)5-8/h8H,3-5H2,1-2H3
InChIKeyOUBOWEWGQBZVLF-UHFFFAOYSA-N
MW131.18 g/mol
LogP0.19
Rot. Bonds3

About N-ethyl-N-(hydroxymethyl)propanamide

N-ethyl-N-(hydroxymethyl)propanamide (PubChem CID 18715922) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is N-ethyl-N-(hydroxymethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-N-(hydroxymethyl)propanamide
PubChem CID18715922
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC NameN-ethyl-N-(hydroxymethyl)propanamide
SMILESCCC(=O)N(CC)CO
InChIInChI=1S/C6H13NO2/c1-3-6(9)7(4-2)5-8/h8H,3-5H2,1-2H3
InChIKeyOUBOWEWGQBZVLF-UHFFFAOYSA-N
XLogP0.19
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-1,3,3-tris(hydroxymethyl)urea
CID 18402780
2-[carboxymethyl(propanoyl)amino]acetic acid
CID 18934284
N-ethyl-N-(2-methylpropyl)propanamide
CID 54345595
N,N-diethylpropanamide;propane;propanenitrile
CID 157233507
N-(3-aminobutyl)-N-ethylpropanamide
CID 134484758
N-ethyl-N-(2-hydroxy-3-methylbutyl)propanamide
CID 59974405
N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide
CID 20740586
2-[2-(diethylamino)-2-oxoethoxy]-N,N-diethylacetamide
CID 12729092
2-(diethylamino)-N,N-diethylacetamide
CID 13352066
N-ethyl-N-[(2S)-2-methoxypropyl]propanamide
CID 172573690
ethane;N-ethyl-N-(4-oxopentyl)propanamide
CID 143803136
2-[ethyl-[2-(propanoylamino)acetyl]amino]acetic acid
CID 115730705

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(hydroxymethyl)propanamide?
The IUPAC name of N-ethyl-N-(hydroxymethyl)propanamide (CID 18715922) is N-ethyl-N-(hydroxymethyl)propanamide.
What is the SMILES notation for N-ethyl-N-(hydroxymethyl)propanamide?
The canonical SMILES for N-ethyl-N-(hydroxymethyl)propanamide is CCC(=O)N(CC)CO.
What is the InChIKey of N-ethyl-N-(hydroxymethyl)propanamide?
The InChIKey is OUBOWEWGQBZVLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-3-6(9)7(4-2)5-8/h8H,3-5H2,1-2H3.
What are the key properties of N-ethyl-N-(hydroxymethyl)propanamide?
N-ethyl-N-(hydroxymethyl)propanamide has a molecular weight of 131.18 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(hydroxymethyl)propanamide is sourced from PubChem (CID 18715922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).