N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide

C13H15ClN4O2 — CID 143392902

IUPACN-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide
SMILESCC1=CC(O)=C(C(=O)Nc2ncc(Cl)cn2)C(C)N1C
InChIInChI=1S/C13H15ClN4O2/c1-7-4-10(19)11(8(2)18(7)3)12(20)17-13-15-5-9(14)6-16-13/h4-6,8,19H,1-3H3,(H,15,16,17,20)
InChIKeyMROXNVSMDDMCCU-UHFFFAOYSA-N
MW294.74 g/mol
LogP2.12
Rot. Bonds2

About N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide

N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide (PubChem CID 143392902) has the molecular formula C13H15ClN4O2 and a molecular weight of 294.74 g/mol. Its IUPAC name is N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide
PubChem CID143392902
Molecular FormulaC13H15ClN4O2
Molecular Weight294.74 g/mol
Exact Mass294.09
IUPAC NameN-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide
SMILESCC1=CC(O)=C(C(=O)Nc2ncc(Cl)cn2)C(C)N1C
InChIInChI=1S/C13H15ClN4O2/c1-7-4-10(19)11(8(2)18(7)3)12(20)17-13-15-5-9(14)6-16-13/h4-6,8,19H,1-3H3,(H,15,16,17,20)
InChIKeyMROXNVSMDDMCCU-UHFFFAOYSA-N
XLogP2.12
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.74
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 144536009
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2-methyl-N-pyrimidin-2-yltriazole-4-carboxamide
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N-(5-chloro-2-methyl-3-pyridinyl)acetamide;ethane
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5-chloro-N-methylpyrimidin-2-amine;dihydrochloride
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2-chloro-N-(5-methylpyrimidin-2-yl)acetamide
CID 167977680
5-chloro-N-(2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide
CID 167928774
N-(5-chloro-2-pyridinyl)-2-hydroxy-5-methylbenzamide
CID 28831587
N-(5-chloropyrimidin-2-yl)-2-(6-methyl-1-oxo-3,4-dihydroisoquinolin-2-yl)acetamide;ethane
CID 169212369

Frequently Asked Questions

What is the IUPAC name of N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide?
The IUPAC name of N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide (CID 143392902) is N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide is CC1=CC(O)=C(C(=O)Nc2ncc(Cl)cn2)C(C)N1C.
What is the InChIKey of N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide?
The InChIKey is MROXNVSMDDMCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O2/c1-7-4-10(19)11(8(2)18(7)3)12(20)17-13-15-5-9(14)6-16-13/h4-6,8,19H,1-3H3,(H,15,16,17,20).
What are the key properties of N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide?
N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide has a molecular weight of 294.74 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloropyrimidin-2-yl)-4-hydroxy-1,2,6-trimethyl-2H-pyridine-3-carboxamide is sourced from PubChem (CID 143392902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).