2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide

C17H19N3O3 — CID 18107041

IUPAC2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)Nc1ncccc1C
InChIInChI=1S/C17H19N3O3/c1-3-23-14-9-5-4-8-13(14)17(22)19-11-15(21)20-16-12(2)7-6-10-18-16/h4-10H,3,11H2,1-2H3,(H,19,22)(H,18,20,21)
InChIKeyWOUIMNUSJPUORI-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.16
Rot. Bonds6

About 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide

2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide (PubChem CID 18107041) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
PubChem CID18107041
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)Nc1ncccc1C
InChIInChI=1S/C17H19N3O3/c1-3-23-14-9-5-4-8-13(14)17(22)19-11-15(21)20-16-12(2)7-6-10-18-16/h4-10H,3,11H2,1-2H3,(H,19,22)(H,18,20,21)
InChIKeyWOUIMNUSJPUORI-UHFFFAOYSA-N
XLogP2.16
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide (CID 18107041) is 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide is CCOc1ccccc1C(=O)NCC(=O)Nc1ncccc1C.
What is the InChIKey of 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The InChIKey is WOUIMNUSJPUORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-3-23-14-9-5-4-8-13(14)17(22)19-11-15(21)20-16-12(2)7-6-10-18-16/h4-10H,3,11H2,1-2H3,(H,19,22)(H,18,20,21).
What are the key properties of 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide has a molecular weight of 313.36 g/mol, XLogP of 2.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 18107041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).