4-hydroxy-N-(2-hydroxyethyl)butanamide

C6H13NO3 — CID 522232

IUPAC4-hydroxy-N-(2-hydroxyethyl)butanamide
SMILESO=C(CCCO)NCCO
InChIInChI=1S/C6H13NO3/c8-4-1-2-6(10)7-3-5-9/h8-9H,1-5H2,(H,7,10)
InChIKeyMFHPPMMWHSHDSI-UHFFFAOYSA-N
MW147.17 g/mol
LogP-1.13
Rot. Bonds5

About 4-hydroxy-N-(2-hydroxyethyl)butanamide

4-hydroxy-N-(2-hydroxyethyl)butanamide (PubChem CID 522232) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is 4-hydroxy-N-(2-hydroxyethyl)butanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-hydroxyethyl)butanamide
PubChem CID522232
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name4-hydroxy-N-(2-hydroxyethyl)butanamide
SMILESO=C(CCCO)NCCO
InChIInChI=1S/C6H13NO3/c8-4-1-2-6(10)7-3-5-9/h8-9H,1-5H2,(H,7,10)
InChIKeyMFHPPMMWHSHDSI-UHFFFAOYSA-N
XLogP-1.13
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-hydroxyethyl)butanamide?
The IUPAC name of 4-hydroxy-N-(2-hydroxyethyl)butanamide (CID 522232) is 4-hydroxy-N-(2-hydroxyethyl)butanamide.
What is the SMILES notation for 4-hydroxy-N-(2-hydroxyethyl)butanamide?
The canonical SMILES for 4-hydroxy-N-(2-hydroxyethyl)butanamide is O=C(CCCO)NCCO.
What is the InChIKey of 4-hydroxy-N-(2-hydroxyethyl)butanamide?
The InChIKey is MFHPPMMWHSHDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c8-4-1-2-6(10)7-3-5-9/h8-9H,1-5H2,(H,7,10).
What are the key properties of 4-hydroxy-N-(2-hydroxyethyl)butanamide?
4-hydroxy-N-(2-hydroxyethyl)butanamide has a molecular weight of 147.17 g/mol, XLogP of -1.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-hydroxyethyl)butanamide is sourced from PubChem (CID 522232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).