N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide

C12H18N2O3 — CID 54993418

IUPACN-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide
SMILESCOCC(O)CN(C)C(=O)c1ccc(C)nc1
InChIInChI=1S/C12H18N2O3/c1-9-4-5-10(6-13-9)12(16)14(2)7-11(15)8-17-3/h4-6,11,15H,7-8H2,1-3H3
InChIKeyOIULPPLBUVFPEY-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.47
Rot. Bonds5

About N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide

N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide (PubChem CID 54993418) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide
PubChem CID54993418
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide
SMILESCOCC(O)CN(C)C(=O)c1ccc(C)nc1
InChIInChI=1S/C12H18N2O3/c1-9-4-5-10(6-13-9)12(16)14(2)7-11(15)8-17-3/h4-6,11,15H,7-8H2,1-3H3
InChIKeyOIULPPLBUVFPEY-UHFFFAOYSA-N
XLogP0.47
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-3-methoxypropyl)-N-methylpyrimidine-5-carboxamide
CID 104627104
methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 43409840
3,5-dihydroxy-N-(2-hydroxy-3-methoxypropyl)-N-methylbenzamide
CID 103892640
N-(2-hydroxy-3-methoxypropyl)-N-methyl-1H-indazole-5-carboxamide
CID 54993384
4-(ethylamino)-N-(2-hydroxy-3-methoxypropyl)-N,3-dimethylbenzamide
CID 63213865
N-(2-hydroxy-3-methoxypropyl)-N,2,6-trimethylbenzamide
CID 103769303
6-bromo-N-(2-hydroxy-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
CID 115283349
N-(2-hydroxy-3-methoxypropyl)-2-methoxy-N-methylpyridine-3-carboxamide
CID 54993522
3-amino-4-fluoro-N-(2-hydroxy-3-methoxypropyl)-N-methylbenzamide
CID 54994745
N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62176231
3-hydrazinyl-N-(2-hydroxy-3-methoxypropyl)-N-methylpyridine-4-carboxamide
CID 105071981
N-(5-hydroxypentyl)-N,6-dimethylpyridine-3-carboxamide
CID 107201918

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide (CID 54993418) is N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide is COCC(O)CN(C)C(=O)c1ccc(C)nc1.
What is the InChIKey of N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide?
The InChIKey is OIULPPLBUVFPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-9-4-5-10(6-13-9)12(16)14(2)7-11(15)8-17-3/h4-6,11,15H,7-8H2,1-3H3.
What are the key properties of N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide?
N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 54993418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).