N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide

C19H21N5O4 — CID 42630418

IUPACN-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide
SMILESCc1onc(-c2ccncn2)c1COc1ccc(C(=O)NC(C)(C)CO)cn1
InChIInChI=1S/C19H21N5O4/c1-12-14(17(24-28-12)15-6-7-20-11-22-15)9-27-16-5-4-13(8-21-16)18(26)23-19(2,3)10-25/h4-8,11,25H,9-10H2,1-3H3,(H,23,26)
InChIKeyWHAGLYKNWUROAY-UHFFFAOYSA-N
MW383.41 g/mol
LogP1.91
Rot. Bonds7

About N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide

N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide (PubChem CID 42630418) has the molecular formula C19H21N5O4 and a molecular weight of 383.41 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide
PubChem CID42630418
Molecular FormulaC19H21N5O4
Molecular Weight383.41 g/mol
Exact Mass383.16
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide
SMILESCc1onc(-c2ccncn2)c1COc1ccc(C(=O)NC(C)(C)CO)cn1
InChIInChI=1S/C19H21N5O4/c1-12-14(17(24-28-12)15-6-7-20-11-22-15)9-27-16-5-4-13(8-21-16)18(26)23-19(2,3)10-25/h4-8,11,25H,9-10H2,1-3H3,(H,23,26)
InChIKeyWHAGLYKNWUROAY-UHFFFAOYSA-N
XLogP1.91
TPSA123.26 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.41
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

4-amino-2-(furan-2-yl)-6-[(2S)-2-hydroxypropoxy]-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-5-carboxamide
CID 147319722
6-[[5-methyl-3-(6-methylpyridin-3-yl)-1,2-oxazol-4-yl]methoxy]-~{N}-[(2~{S})-1-oxidanylpentan-2-yl]pyridine-3-carboxamide
CID 134604371
n-(2-Hydroxy-1-methyl-ethyl)-6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-nicotinamide
CID 42629454
N-((S)-1-Hydroxymethyl-propyl)-6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-nicotinamide
CID 42629686
N-Isopropyl-6-(5-methyl-3-pyridin-2-yl-isoxazol-4-ylmethoxy)-nicotinamide
CID 42630166
N-ethyl-6-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methoxy]pyridine-3-carboxamide
CID 42630292
N-[(2S)-1-hydroxypropan-2-yl]-6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide
CID 57521073
6-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 68443348
6-(5-Methyl-3-pyridin-2-yl-isoxazol-4-ylmethoxy)-N-(tetrahydro-pyran-4-yl)-nicotinamide
CID 68444799
N-(2-hydroxyethyl)-6-[(5-methyl-3-piperidin-2-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide
CID 90683543
6-[[3-(5-fluoropiperidin-2-yl)-5-methyl-1,2-oxazol-4-yl]methoxy]-N-propan-2-ylpyridine-3-carboxamide
CID 90683546
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(4-methyl-2-pyridinyl)benzamide
CID 25162694

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide (CID 42630418) is N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide is Cc1onc(-c2ccncn2)c1COc1ccc(C(=O)NC(C)(C)CO)cn1.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide?
The InChIKey is WHAGLYKNWUROAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O4/c1-12-14(17(24-28-12)15-6-7-20-11-22-15)9-27-16-5-4-13(8-21-16)18(26)23-19(2,3)10-25/h4-8,11,25H,9-10H2,1-3H3,(H,23,26).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide?
N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide has a molecular weight of 383.41 g/mol, XLogP of 1.91, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)-6-[(5-methyl-3-pyrimidin-4-yl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide is sourced from PubChem (CID 42630418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).