N-ethyl-3,4-dihydroxybutanamide

C6H13NO3 — CID 18386927

IUPACN-ethyl-3,4-dihydroxybutanamide
SMILESCCNC(=O)CC(O)CO
InChIInChI=1S/C6H13NO3/c1-2-7-6(10)3-5(9)4-8/h5,8-9H,2-4H2,1H3,(H,7,10)
InChIKeyGUZHWHSNZJZQPY-UHFFFAOYSA-N
MW147.17 g/mol
LogP-1.13
Rot. Bonds4

About N-ethyl-3,4-dihydroxybutanamide

N-ethyl-3,4-dihydroxybutanamide (PubChem CID 18386927) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is N-ethyl-3,4-dihydroxybutanamide.

Molecular Properties

Compound NameN-ethyl-3,4-dihydroxybutanamide
PubChem CID18386927
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC NameN-ethyl-3,4-dihydroxybutanamide
SMILESCCNC(=O)CC(O)CO
InChIInChI=1S/C6H13NO3/c1-2-7-6(10)3-5(9)4-8/h5,8-9H,2-4H2,1H3,(H,7,10)
InChIKeyGUZHWHSNZJZQPY-UHFFFAOYSA-N
XLogP-1.13
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
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 N-ethyl-3,4-dihydroxybutanamide?
The IUPAC name of N-ethyl-3,4-dihydroxybutanamide (CID 18386927) is N-ethyl-3,4-dihydroxybutanamide.
What is the SMILES notation for N-ethyl-3,4-dihydroxybutanamide?
The canonical SMILES for N-ethyl-3,4-dihydroxybutanamide is CCNC(=O)CC(O)CO.
What is the InChIKey of N-ethyl-3,4-dihydroxybutanamide?
The InChIKey is GUZHWHSNZJZQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-2-7-6(10)3-5(9)4-8/h5,8-9H,2-4H2,1H3,(H,7,10).
What are the key properties of N-ethyl-3,4-dihydroxybutanamide?
N-ethyl-3,4-dihydroxybutanamide has a molecular weight of 147.17 g/mol, XLogP of -1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,4-dihydroxybutanamide is sourced from PubChem (CID 18386927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).