2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide

C16H19N3O — CID 60962477

IUPAC2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
SMILESCCN(Cc1ccncc1)C(=O)CNc1ccccc1
InChIInChI=1S/C16H19N3O/c1-2-19(13-14-8-10-17-11-9-14)16(20)12-18-15-6-4-3-5-7-15/h3-11,18H,2,12-13H2,1H3
InChIKeyVCANCQPYOSMNGO-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.54
Rot. Bonds6

About 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide

2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide (PubChem CID 60962477) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
PubChem CID60962477
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
SMILESCCN(Cc1ccncc1)C(=O)CNc1ccccc1
InChIInChI=1S/C16H19N3O/c1-2-19(13-14-8-10-17-11-9-14)16(20)12-18-15-6-4-3-5-7-15/h3-11,18H,2,12-13H2,1H3
InChIKeyVCANCQPYOSMNGO-UHFFFAOYSA-N
XLogP2.54
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N,N-diethylacetamide;hydrochloride
CID 119671427
N-ethyl-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 564270
2-anilino-N-benzyl-N-propylacetamide;hydrochloride
CID 119681623
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide
CID 108999046
2-anilino-N-ethyl-N-(2-phenylethyl)acetamide
CID 60946372
2-anilino-N-ethyl-N-(2-hydroxyethyl)acetamide
CID 60945484
methyl 3-[[2-[benzyl(ethyl)amino]-2-oxoethyl]amino]benzoate
CID 108999033
N-benzyl-2-(3-cyanoanilino)-N-ethylacetamide
CID 32899277
N-benzyl-N-ethyl-2-(1,3-thiazol-2-ylamino)acetamide
CID 110694015
N-benzyl-N-ethyl-2-(phenylcarbamoylamino)acetamide
CID 112992911
2-[[ethyl(pyridin-4-ylmethyl)carbamoyl]amino]acetic acid
CID 61449449

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
The IUPAC name of 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide (CID 60962477) is 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
The canonical SMILES for 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide is CCN(Cc1ccncc1)C(=O)CNc1ccccc1.
What is the InChIKey of 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
The InChIKey is VCANCQPYOSMNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-2-19(13-14-8-10-17-11-9-14)16(20)12-18-15-6-4-3-5-7-15/h3-11,18H,2,12-13H2,1H3.
What are the key properties of 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide has a molecular weight of 269.35 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide is sourced from PubChem (CID 60962477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).