3-ethoxy-N-(2-hydroxypropyl)propanamide

C8H17NO3 — CID 62589549

IUPAC3-ethoxy-N-(2-hydroxypropyl)propanamide
SMILESCCOCCC(=O)NCC(C)O
InChIInChI=1S/C8H17NO3/c1-3-12-5-4-8(11)9-6-7(2)10/h7,10H,3-6H2,1-2H3,(H,9,11)
InChIKeyBAGVKTZMVFCCBG-UHFFFAOYSA-N
MW175.23 g/mol
LogP-0.09
Rot. Bonds6

About 3-ethoxy-N-(2-hydroxypropyl)propanamide

3-ethoxy-N-(2-hydroxypropyl)propanamide (PubChem CID 62589549) has the molecular formula C8H17NO3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 3-ethoxy-N-(2-hydroxypropyl)propanamide.

Molecular Properties

Compound Name3-ethoxy-N-(2-hydroxypropyl)propanamide
PubChem CID62589549
Molecular FormulaC8H17NO3
Molecular Weight175.23 g/mol
Exact Mass175.12
IUPAC Name3-ethoxy-N-(2-hydroxypropyl)propanamide
SMILESCCOCCC(=O)NCC(C)O
InChIInChI=1S/C8H17NO3/c1-3-12-5-4-8(11)9-6-7(2)10/h7,10H,3-6H2,1-2H3,(H,9,11)
InChIKeyBAGVKTZMVFCCBG-UHFFFAOYSA-N
XLogP-0.09
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2R)-2-hydroxypropyl]-3-propoxypropanamide
CID 83060047
N-(2,2-dimethoxyethyl)-3-ethoxypropanamide
CID 62966631
3-ethoxy-N-ethylpropanamide
CID 58030283
N-(2-cyclopentyl-2-hydroxyethyl)-3-ethoxypropanamide
CID 111425977
3-[(3-ethoxypropanoylamino)methyl]-5-methylhexanoic acid
CID 65494349
N-[(2S)-2-hydroxypropyl]-4-methylpentanamide
CID 83030953
4-ethoxy-N-(3-ethyl-2-hydroxypentyl)butanamide
CID 113234511
3-chloro-N-(2-hydroxypropyl)propanamide
CID 59011978
N'-hydroxy-N-(2-hydroxypropyl)butanediamide
CID 86244799
N-(2-hydroxypropyl)nonadecanamide
CID 102118860
2-bromo-N-(2-hydroxypropyl)acetamide
CID 63679537
3-ethoxy-N-(2-hydroxy-2-methylpropyl)propanamide
CID 65109921

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(2-hydroxypropyl)propanamide?
The IUPAC name of 3-ethoxy-N-(2-hydroxypropyl)propanamide (CID 62589549) is 3-ethoxy-N-(2-hydroxypropyl)propanamide.
What is the SMILES notation for 3-ethoxy-N-(2-hydroxypropyl)propanamide?
The canonical SMILES for 3-ethoxy-N-(2-hydroxypropyl)propanamide is CCOCCC(=O)NCC(C)O.
What is the InChIKey of 3-ethoxy-N-(2-hydroxypropyl)propanamide?
The InChIKey is BAGVKTZMVFCCBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3/c1-3-12-5-4-8(11)9-6-7(2)10/h7,10H,3-6H2,1-2H3,(H,9,11).
What are the key properties of 3-ethoxy-N-(2-hydroxypropyl)propanamide?
3-ethoxy-N-(2-hydroxypropyl)propanamide has a molecular weight of 175.23 g/mol, XLogP of -0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(2-hydroxypropyl)propanamide is sourced from PubChem (CID 62589549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).