2-hydroxy-3-methoxypentanamide

C6H13NO3 — CID 131162764

IUPAC2-hydroxy-3-methoxypentanamide
SMILESCCC(OC)C(O)C(N)=O
InChIInChI=1S/C6H13NO3/c1-3-4(10-2)5(8)6(7)9/h4-5,8H,3H2,1-2H3,(H2,7,9)
InChIKeyKTEUOJKUKZCYEN-UHFFFAOYSA-N
MW147.17 g/mol
LogP-0.74
Rot. Bonds4

About 2-hydroxy-3-methoxypentanamide

2-hydroxy-3-methoxypentanamide (PubChem CID 131162764) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is 2-hydroxy-3-methoxypentanamide.

Molecular Properties

Compound Name2-hydroxy-3-methoxypentanamide
PubChem CID131162764
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name2-hydroxy-3-methoxypentanamide
SMILESCCC(OC)C(O)C(N)=O
InChIInChI=1S/C6H13NO3/c1-3-4(10-2)5(8)6(7)9/h4-5,8H,3H2,1-2H3,(H2,7,9)
InChIKeyKTEUOJKUKZCYEN-UHFFFAOYSA-N
XLogP-0.74
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3R)-2-hydroxy-3-methoxybutanediamide
CID 131227841
(3S,4R,5S,6R)-3,4,5,6-tetramethoxyoctane
CID 59693568
2-amino-4-methoxy-2-methylhexan-3-ol
CID 131223231
4-methoxy-2-methylhexan-3-ol
CID 116710715
(4-acetyloxy-3-hydroxy-2-methoxyhexyl) acetate
CID 139334876
2-hydroxybutanamide;hydrochloride
CID 87384831
methyl (2S,3R)-2-hydroxy-3-methylpentanoate
CID 13262415
3-methoxyheptan-4-ol
CID 54045994
2-ethoxy-2-methoxyacetamide
CID 54503538
methyl (2R,3R)-2-hydroxy-3-methylpentanoate
CID 13262413
2-hydroxy-3-methylhexanamide
CID 62226604
ethyl 3-(hydroxymethyl)-4-methoxy-2-methylhexanoate
CID 167600424

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxypentanamide?
The IUPAC name of 2-hydroxy-3-methoxypentanamide (CID 131162764) is 2-hydroxy-3-methoxypentanamide.
What is the SMILES notation for 2-hydroxy-3-methoxypentanamide?
The canonical SMILES for 2-hydroxy-3-methoxypentanamide is CCC(OC)C(O)C(N)=O.
What is the InChIKey of 2-hydroxy-3-methoxypentanamide?
The InChIKey is KTEUOJKUKZCYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-3-4(10-2)5(8)6(7)9/h4-5,8H,3H2,1-2H3,(H2,7,9).
What are the key properties of 2-hydroxy-3-methoxypentanamide?
2-hydroxy-3-methoxypentanamide has a molecular weight of 147.17 g/mol, XLogP of -0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methoxypentanamide is sourced from PubChem (CID 131162764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).