2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide

C17H25N3O3 — CID 113177265

IUPAC2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide
SMILESCC(=O)N(CC(=O)NC(C)C)c1ccccc1N1CCOCC1
InChIInChI=1S/C17H25N3O3/c1-13(2)18-17(22)12-20(14(3)21)16-7-5-4-6-15(16)19-8-10-23-11-9-19/h4-7,13H,8-12H2,1-3H3,(H,18,22)
InChIKeyKAKZXUOFZYCBHW-UHFFFAOYSA-N
MW319.41 g/mol
LogP1.40
Rot. Bonds5

About 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide

2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide (PubChem CID 113177265) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide
PubChem CID113177265
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC Name2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide
SMILESCC(=O)N(CC(=O)NC(C)C)c1ccccc1N1CCOCC1
InChIInChI=1S/C17H25N3O3/c1-13(2)18-17(22)12-20(14(3)21)16-7-5-4-6-15(16)19-8-10-23-11-9-19/h4-7,13H,8-12H2,1-3H3,(H,18,22)
InChIKeyKAKZXUOFZYCBHW-UHFFFAOYSA-N
XLogP1.40
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(N-acetyl-2-morpholin-4-ylanilino)-N-cyclopropylpropanamide
CID 113132150
3-(N-acetyl-2-morpholin-4-ylanilino)-N-cyclohexylpropanamide
CID 113132158
2-(N-acetyl-2-morpholin-4-ylanilino)-N-butyl-N-methylacetamide
CID 113177315
3-(N-acetyl-2-morpholin-4-ylanilino)-N-(4-methylphenyl)propanamide
CID 113132196
ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate
CID 113062485
2-[acetyl(propan-2-yl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113158255
2-(N-acetyl-2,4,6-trimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 113170062
3-(N-acetyl-2-morpholin-4-ylanilino)-N-(pyridin-3-ylmethyl)propanamide
CID 113132180
2-[acetyl(butan-2-yl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113159164
3-(N-acetyl-2-fluoroanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 113126781
N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
CID 113000312
2-(N-acetyl-2,5-dichloroanilino)-N-propan-2-ylacetamide
CID 113179672

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
The IUPAC name of 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide (CID 113177265) is 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide is CC(=O)N(CC(=O)NC(C)C)c1ccccc1N1CCOCC1.
What is the InChIKey of 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
The InChIKey is KAKZXUOFZYCBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-13(2)18-17(22)12-20(14(3)21)16-7-5-4-6-15(16)19-8-10-23-11-9-19/h4-7,13H,8-12H2,1-3H3,(H,18,22).
What are the key properties of 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide has a molecular weight of 319.41 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide is sourced from PubChem (CID 113177265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).