5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide

C9H19NO4 — CID 89464995

IUPAC5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide
SMILESCOC(CCO)C(OC)C(=O)N(C)C
InChIInChI=1S/C9H19NO4/c1-10(2)9(12)8(14-4)7(13-3)5-6-11/h7-8,11H,5-6H2,1-4H3
InChIKeyVBKADDASVLIQIL-UHFFFAOYSA-N
MW205.25 g/mol
LogP-0.51
Rot. Bonds6

About 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide

5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide (PubChem CID 89464995) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide.

Molecular Properties

Compound Name5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide
PubChem CID89464995
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC Name5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide
SMILESCOC(CCO)C(OC)C(=O)N(C)C
InChIInChI=1S/C9H19NO4/c1-10(2)9(12)8(14-4)7(13-3)5-6-11/h7-8,11H,5-6H2,1-4H3
InChIKeyVBKADDASVLIQIL-UHFFFAOYSA-N
XLogP-0.51
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-4-hydroxy-N,N-dimethylbutanamide
CID 89160145
(1,6-dihydroxy-4,5-dimethoxyhexan-3-yl) acetate
CID 168951553
(2R,3R)-2,3-bis[2-(dimethylamino)-2-oxoethoxy]-N,N,N',N'-tetramethylbutanediamide
CID 12695224
(2R,3R,4R)-2,3,5-tributoxy-4-methoxy-N,N-dimethylpentanamide
CID 175624547
[(2S)-1-(dimethylamino)-3-hydroxy-1-oxopropan-2-yl] carbamate
CID 170171988
tert-butyl N-[(2S)-4-hydroxy-1-[methoxy(methyl)amino]-1-oxobutan-2-yl]carbamate
CID 10858271
(2S,3R)-2,3-dimethoxybutane-1,4-diol
CID 119097957
(2R,3S)-N,3-dimethoxy-N,2-dimethylpentanamide
CID 71492099
(3R)-4-methoxy-3-propylhexan-1-ol
CID 89361343
(2S)-2-(2-hydroxyethylamino)-N,N-dimethylpropanamide
CID 86625703
2-ethyl-N,N-dimethylhexanamide
CID 3019000
(4S)-4-methoxy-5-methylhexan-1-ol
CID 131848315

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide?
The IUPAC name of 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide (CID 89464995) is 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide.
What is the SMILES notation for 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide?
The canonical SMILES for 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide is COC(CCO)C(OC)C(=O)N(C)C.
What is the InChIKey of 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide?
The InChIKey is VBKADDASVLIQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-10(2)9(12)8(14-4)7(13-3)5-6-11/h7-8,11H,5-6H2,1-4H3.
What are the key properties of 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide?
5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide has a molecular weight of 205.25 g/mol, XLogP of -0.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2,3-dimethoxy-N,N-dimethylpentanamide is sourced from PubChem (CID 89464995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).