(2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide

C11H21NO6 — CID 101085988

IUPAC(2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide
SMILESCO[C@H]1O[C@H](C)[C@@H](NC(=O)[C@@H](C)O)[C@H](O)[C@@H]1OC
InChIInChI=1S/C11H21NO6/c1-5(13)10(15)12-7-6(2)18-11(17-4)9(16-3)8(7)14/h5-9,11,13-14H,1-4H3,(H,12,15)/t5-,6-,7-,8+,9+,11+/m1/s1
InChIKeyLNQACFBEOMFPLI-CWJAVHARSA-N
MW263.29 g/mol
LogP-1.38
Rot. Bonds4

About (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide

(2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide (PubChem CID 101085988) has the molecular formula C11H21NO6 and a molecular weight of 263.29 g/mol. Its IUPAC name is (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide
PubChem CID101085988
Molecular FormulaC11H21NO6
Molecular Weight263.29 g/mol
Exact Mass263.14
IUPAC Name(2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide
SMILESCO[C@H]1O[C@H](C)[C@@H](NC(=O)[C@@H](C)O)[C@H](O)[C@@H]1OC
InChIInChI=1S/C11H21NO6/c1-5(13)10(15)12-7-6(2)18-11(17-4)9(16-3)8(7)14/h5-9,11,13-14H,1-4H3,(H,12,15)/t5-,6-,7-,8+,9+,11+/m1/s1
InChIKeyLNQACFBEOMFPLI-CWJAVHARSA-N
XLogP-1.38
TPSA97.25 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 5-1.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide with MolForge

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Related Compounds

(2R)-N-[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-methoxy-2-methyloxan-3-yl]-2,4-dihydroxybutanamide
CID 101085995
(2R)-N-[(2R,3R,4S,5R,6S)-4-fluoro-5,6-dimethoxy-2-methyloxan-3-yl]-2,4-dihydroxybutanamide
CID 101128016
N-[(2S,3S,4R,5R,6R)-3,5-dihydroxy-2-methoxy-6-methyloxan-4-yl]acetamide
CID 57012935
N-[(2S,3R,4R,5R,6S)-3,5-dihydroxy-2-methoxy-6-methyloxan-4-yl]acetamide
CID 70005624
(2R,3R,4S,5R,6S)-4,5,6-trimethoxy-2-methyloxan-3-ol
CID 13122553
methyl 3,4-dihydroxy-5,6-dimethoxyoxane-2-carboxylate
CID 554147
(2S)-2-hydroxy-N-[(3S,4R)-4-methoxyoxolan-3-yl]propanamide
CID 130758102
N-[(3S,6R)-4,6-dihydroxy-5-methoxy-2-methyloxan-3-yl]-3-hydroxy-3-methylbutanamide
CID 46780463
(2S)-2-hydroxy-N-(3-methoxycyclobutyl)propanamide
CID 131069206
[(2R,3S,4R,5R,6S)-3,5-dihydroxy-2-methoxy-6-methyloxan-4-yl] 2-methylpropanoate
CID 132992149
[(3S,4R,5S,6S)-4,5-dihydroxy-2-methoxy-6-methyloxan-3-yl] acetate
CID 21307891
[3-[[(3S,4R,6S)-5-acetamido-4-hydroxy-3-methoxy-6-methyloxan-2-yl]methoxy]-2-hydroxypropyl]-trimethylazanium
CID 167334566

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide?
The IUPAC name of (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide (CID 101085988) is (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide.
What is the SMILES notation for (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide?
The canonical SMILES for (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide is CO[C@H]1O[C@H](C)[C@@H](NC(=O)[C@@H](C)O)[C@H](O)[C@@H]1OC.
What is the InChIKey of (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide?
The InChIKey is LNQACFBEOMFPLI-CWJAVHARSA-N. The full InChI is InChI=1S/C11H21NO6/c1-5(13)10(15)12-7-6(2)18-11(17-4)9(16-3)8(7)14/h5-9,11,13-14H,1-4H3,(H,12,15)/t5-,6-,7-,8+,9+,11+/m1/s1.
What are the key properties of (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide?
(2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide has a molecular weight of 263.29 g/mol, XLogP of -1.38, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-N-[(2R,3S,4S,5S,6S)-4-hydroxy-5,6-dimethoxy-2-methyloxan-3-yl]propanamide is sourced from PubChem (CID 101085988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).