2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide

C16H19N3O — CID 108999248

IUPAC2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide
SMILESCCc1ccccc1NCC(=O)NCc1ccccn1
InChIInChI=1S/C16H19N3O/c1-2-13-7-3-4-9-15(13)18-12-16(20)19-11-14-8-5-6-10-17-14/h3-10,18H,2,11-12H2,1H3,(H,19,20)
InChIKeyMWSZDAXAWJPZIA-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.37
Rot. Bonds6

About 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide

2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 108999248) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID108999248
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide
SMILESCCc1ccccc1NCC(=O)NCc1ccccn1
InChIInChI=1S/C16H19N3O/c1-2-13-7-3-4-9-15(13)18-12-16(20)19-11-14-8-5-6-10-17-14/h3-10,18H,2,11-12H2,1H3,(H,19,20)
InChIKeyMWSZDAXAWJPZIA-UHFFFAOYSA-N
XLogP2.37
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide (CID 108999248) is 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide is CCc1ccccc1NCC(=O)NCc1ccccn1.
What is the InChIKey of 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is MWSZDAXAWJPZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-2-13-7-3-4-9-15(13)18-12-16(20)19-11-14-8-5-6-10-17-14/h3-10,18H,2,11-12H2,1H3,(H,19,20).
What are the key properties of 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide?
2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 269.35 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 108999248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).