N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide

C19H26N2O2 — CID 51255120

IUPACN-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide
SMILESCN(CC12CC3CC(CC(C3)C1)C2)C(=O)Cn1ccccc1=O
InChIInChI=1S/C19H26N2O2/c1-20(18(23)12-21-5-3-2-4-17(21)22)13-19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-13H2,1H3
InChIKeyCZMCIFVXCJVMEY-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.52
Rot. Bonds4

About N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide

N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 51255120) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID51255120
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide
SMILESCN(CC12CC3CC(CC(C3)C1)C2)C(=O)Cn1ccccc1=O
InChIInChI=1S/C19H26N2O2/c1-20(18(23)12-21-5-3-2-4-17(21)22)13-19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-13H2,1H3
InChIKeyCZMCIFVXCJVMEY-UHFFFAOYSA-N
XLogP2.52
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide (CID 51255120) is N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide is CN(CC12CC3CC(CC(C3)C1)C2)C(=O)Cn1ccccc1=O.
What is the InChIKey of N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is CZMCIFVXCJVMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-20(18(23)12-21-5-3-2-4-17(21)22)13-19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-13H2,1H3.
What are the key properties of N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide?
N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 314.43 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantylmethyl)-N-methyl-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 51255120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).