N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide

C12H18N2O2 — CID 86304111

IUPACN-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide
SMILESCCCC(=O)Nc1nc(C)c(O)c(C)c1C
InChIInChI=1S/C12H18N2O2/c1-5-6-10(15)14-12-8(3)7(2)11(16)9(4)13-12/h16H,5-6H2,1-4H3,(H,13,14,15)
InChIKeyMVYAAXXMRFSEPK-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.45
Rot. Bonds3

About N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide

N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide (PubChem CID 86304111) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide.

Molecular Properties

Compound NameN-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide
PubChem CID86304111
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide
SMILESCCCC(=O)Nc1nc(C)c(O)c(C)c1C
InChIInChI=1S/C12H18N2O2/c1-5-6-10(15)14-12-8(3)7(2)11(16)9(4)13-12/h16H,5-6H2,1-4H3,(H,13,14,15)
InChIKeyMVYAAXXMRFSEPK-UHFFFAOYSA-N
XLogP2.45
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-hydroxy-5,7-dimethyl-3,4-dihydro-1H-pyrido[2,3-d]pyrimidin-2-one
CID 72164894
N-(5-hydroxy-3,4,6-trimethylpyridine-2-yl)acetamide
CID 86271984
N-(5-hydroxy-3,4,6-trimethylpyridine-2-yl)-3-phenylpropanamide
CID 86304263
6-Amino-2,4,5-trimethylpyridin-3-ol
CID 71622385
6-(Hexylamino)-2,4,5-trimethylpyridin-3-ol
CID 71622386
6-(Hexadecylamino)-2,4,5-trimethylpyridin-3-ol
CID 71622513
6-(3-Hydroxypropylamino)-2,4,5-trimethylpyridin-3-ol
CID 71622514
6-(Cyclohexylamino)-2,4,5-trimethylpyridin-3-ol
CID 71622516
6-(Benzylamino)-2,4,5-trimethylpyridin-3-ol
CID 71622517
2,4,5-Trimethyl-6-(phenylamino)pyridin-3-ol
CID 71622518
2,4,5-Trimethyl-6-(pyrrolidin-1-yl)pyridin-3-ol
CID 71622658
2,4,5-Trimethyl-6-(4-methylpiperazin-1-yl)pyridin-3-ol
CID 71622659

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide?
The IUPAC name of N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide (CID 86304111) is N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide.
What is the SMILES notation for N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide?
The canonical SMILES for N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide is CCCC(=O)Nc1nc(C)c(O)c(C)c1C.
What is the InChIKey of N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide?
The InChIKey is MVYAAXXMRFSEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-5-6-10(15)14-12-8(3)7(2)11(16)9(4)13-12/h16H,5-6H2,1-4H3,(H,13,14,15).
What are the key properties of N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide?
N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide has a molecular weight of 222.29 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-3,4,6-trimethyl-2-pyridinyl)butanamide is sourced from PubChem (CID 86304111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).