N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide

C11H16N2O3 — CID 170829544

IUPACN-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide
SMILESCC(=O)NCC(O)C(O)c1ccc(C)nc1
InChIInChI=1S/C11H16N2O3/c1-7-3-4-9(5-12-7)11(16)10(15)6-13-8(2)14/h3-5,10-11,15-16H,6H2,1-2H3,(H,13,14)
InChIKeyOAUBYSRYSBUHME-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.08
Rot. Bonds4

About N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide

N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide (PubChem CID 170829544) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide.

Molecular Properties

Compound NameN-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide
PubChem CID170829544
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC NameN-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide
SMILESCC(=O)NCC(O)C(O)c1ccc(C)nc1
InChIInChI=1S/C11H16N2O3/c1-7-3-4-9(5-12-7)11(16)10(15)6-13-8(2)14/h3-5,10-11,15-16H,6H2,1-2H3,(H,13,14)
InChIKeyOAUBYSRYSBUHME-UHFFFAOYSA-N
XLogP-0.08
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(4-aminophenyl)-2,3-dihydroxypropyl]acetamide
CID 170829554
N-(2,3-dihydroxy-3-pyrimidin-5-ylpropyl)acetamide
CID 170829458
1-(6-methyl-3-pyridinyl)propane-1,2,3-triol
CID 170817362
N-[3-(4-chlorophenyl)-2,3-dihydroxypropyl]acetamide
CID 170829480
1-(6-methyl-3-pyridinyl)-3-sulfanylpropane-1,2-diol
CID 170819362
4-(3-acetamido-1,2-dihydroxypropyl)benzoic acid
CID 170829918
N-[2,3-dihydroxy-3-(1H-pyrazolo[4,5-b]pyridin-6-yl)propyl]acetamide
CID 170830236
N-[3-(3-bromo-4-methylphenyl)-2,3-dihydroxypropyl]acetamide
CID 170831130
N-[3-(5-amino-6-chloro-3-pyridinyl)-2,3-dihydroxypropyl]acetamide
CID 170829700
[4-(3-acetamido-1,2-dihydroxypropyl)phenyl] acetate
CID 170831378
N-[3-[4-(hydrazinecarbonyl)phenyl]-2,3-dihydroxypropyl]acetamide
CID 170830453
N-[4-(6-amino-3-pyridinyl)-3,4-dihydroxybutyl]acetamide
CID 171882499

Frequently Asked Questions

What is the IUPAC name of N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide?
The IUPAC name of N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide (CID 170829544) is N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide.
What is the SMILES notation for N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide?
The canonical SMILES for N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide is CC(=O)NCC(O)C(O)c1ccc(C)nc1.
What is the InChIKey of N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide?
The InChIKey is OAUBYSRYSBUHME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-7-3-4-9(5-12-7)11(16)10(15)6-13-8(2)14/h3-5,10-11,15-16H,6H2,1-2H3,(H,13,14).
What are the key properties of N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide?
N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide has a molecular weight of 224.26 g/mol, XLogP of -0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3-dihydroxy-3-(6-methyl-3-pyridinyl)propyl]acetamide is sourced from PubChem (CID 170829544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).