N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide

C18H20N2O3 — CID 51206707

IUPACN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide
SMILESCOc1ccc(CN(C(=O)Cn2ccccc2=O)C2CC2)cc1
InChIInChI=1S/C18H20N2O3/c1-23-16-9-5-14(6-10-16)12-20(15-7-8-15)18(22)13-19-11-3-2-4-17(19)21/h2-6,9-11,15H,7-8,12-13H2,1H3
InChIKeyWQGVHZPGNWOSRW-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.05
Rot. Bonds6

About N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide

N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 51206707) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID51206707
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide
SMILESCOc1ccc(CN(C(=O)Cn2ccccc2=O)C2CC2)cc1
InChIInChI=1S/C18H20N2O3/c1-23-16-9-5-14(6-10-16)12-20(15-7-8-15)18(22)13-19-11-3-2-4-17(19)21/h2-6,9-11,15H,7-8,12-13H2,1H3
InChIKeyWQGVHZPGNWOSRW-UHFFFAOYSA-N
XLogP2.05
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide (CID 51206707) is N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide is COc1ccc(CN(C(=O)Cn2ccccc2=O)C2CC2)cc1.
What is the InChIKey of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is WQGVHZPGNWOSRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-23-16-9-5-14(6-10-16)12-20(15-7-8-15)18(22)13-19-11-3-2-4-17(19)21/h2-6,9-11,15H,7-8,12-13H2,1H3.
What are the key properties of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide?
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 312.37 g/mol, XLogP of 2.05, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 51206707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).