N-(2-hydroxyethyl)-3-methoxypropanamide

C6H13NO3 — CID 15430830

IUPACN-(2-hydroxyethyl)-3-methoxypropanamide
SMILESCOCCC(=O)NCCO
InChIInChI=1S/C6H13NO3/c1-10-5-2-6(9)7-3-4-8/h8H,2-5H2,1H3,(H,7,9)
InChIKeyOUBLOFZFNZSRQY-UHFFFAOYSA-N
MW147.17 g/mol
LogP-0.87
Rot. Bonds5

About N-(2-hydroxyethyl)-3-methoxypropanamide

N-(2-hydroxyethyl)-3-methoxypropanamide (PubChem CID 15430830) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3-methoxypropanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3-methoxypropanamide
PubChem CID15430830
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC NameN-(2-hydroxyethyl)-3-methoxypropanamide
SMILESCOCCC(=O)NCCO
InChIInChI=1S/C6H13NO3/c1-10-5-2-6(9)7-3-4-8/h8H,2-5H2,1H3,(H,7,9)
InChIKeyOUBLOFZFNZSRQY-UHFFFAOYSA-N
XLogP-0.87
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-0.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3-methoxypropanamide?
The IUPAC name of N-(2-hydroxyethyl)-3-methoxypropanamide (CID 15430830) is N-(2-hydroxyethyl)-3-methoxypropanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3-methoxypropanamide?
The canonical SMILES for N-(2-hydroxyethyl)-3-methoxypropanamide is COCCC(=O)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-3-methoxypropanamide?
The InChIKey is OUBLOFZFNZSRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-10-5-2-6(9)7-3-4-8/h8H,2-5H2,1H3,(H,7,9).
What are the key properties of N-(2-hydroxyethyl)-3-methoxypropanamide?
N-(2-hydroxyethyl)-3-methoxypropanamide has a molecular weight of 147.17 g/mol, XLogP of -0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3-methoxypropanamide is sourced from PubChem (CID 15430830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).