N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide

C19H26N2O3 — CID 99716852

IUPACN-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide
SMILESCc1cc(O)cc(=O)n1CC(=O)N(C)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C19H26N2O3/c1-11-3-16(22)9-17(23)21(11)10-18(24)20(2)19-14-5-12-4-13(7-14)8-15(19)6-12/h3,9,12-15,19,22H,4-8,10H2,1-2H3
InChIKeyGAYPECRCHCWTKS-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.15
Rot. Bonds3

About N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide

N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide (PubChem CID 99716852) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide
PubChem CID99716852
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide
SMILESCc1cc(O)cc(=O)n1CC(=O)N(C)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C19H26N2O3/c1-11-3-16(22)9-17(23)21(11)10-18(24)20(2)19-14-5-12-4-13(7-14)8-15(19)6-12/h3,9,12-15,19,22H,4-8,10H2,1-2H3
InChIKeyGAYPECRCHCWTKS-UHFFFAOYSA-N
XLogP2.15
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide?
The IUPAC name of N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide (CID 99716852) is N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide.
What is the SMILES notation for N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide?
The canonical SMILES for N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide is Cc1cc(O)cc(=O)n1CC(=O)N(C)C1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide?
The InChIKey is GAYPECRCHCWTKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-11-3-16(22)9-17(23)21(11)10-18(24)20(2)19-14-5-12-4-13(7-14)8-15(19)6-12/h3,9,12-15,19,22H,4-8,10H2,1-2H3.
What are the key properties of N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide?
N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide has a molecular weight of 330.43 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide is sourced from PubChem (CID 99716852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).