4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide

C17H24N2O3 — CID 27258300

IUPAC4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
SMILESCC(C)(C)c1ccc(C(=O)NCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H24N2O3/c1-17(2,3)14-6-4-13(5-7-14)16(21)18-12-15(20)19-8-10-22-11-9-19/h4-7H,8-12H2,1-3H3,(H,18,21)
InChIKeyRFDMTNIGDKTKCA-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.57
Rot. Bonds3

About 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide

4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide (PubChem CID 27258300) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
PubChem CID27258300
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
SMILESCC(C)(C)c1ccc(C(=O)NCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H24N2O3/c1-17(2,3)14-6-4-13(5-7-14)16(21)18-12-15(20)19-8-10-22-11-9-19/h4-7H,8-12H2,1-3H3,(H,18,21)
InChIKeyRFDMTNIGDKTKCA-UHFFFAOYSA-N
XLogP1.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-tert-butylbenzamide
CID 34839400
4-ethoxy-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 27258304
4-tert-butyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 51163379
4-tert-butyl-N-[2-oxo-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]ethyl]benzamide
CID 36802749
ethane;4-fluoro-N-(2-morpholin-4-yl-2-oxoethyl)benzamide;2-methylsulfanylethanol
CID 145138996
N-(2-morpholin-4-yl-2-oxoethyl)-4-piperidin-1-ylsulfonylbenzamide
CID 112991295
4-tert-butyl-N-[2-oxo-2-[4-(1-oxo-1-piperidin-1-ylpropan-2-yl)piperazin-1-yl]ethyl]benzamide
CID 86891176
4-tert-butyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]benzamide
CID 17475542
ethane;4-fluoro-N-(2-morpholin-4-yl-2-oxoethyl)benzamide;2-methylsulfanylethanamine
CID 145139009
4-tert-butyl-N-(morpholine-4-carbothioyl)benzamide
CID 2732832
1-[2-[(4-tert-butylbenzoyl)amino]acetyl]pyrrolidine-3-carboxylic acid
CID 120533814
3-iodo-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 113352781

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide?
The IUPAC name of 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide (CID 27258300) is 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide.
What is the SMILES notation for 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide?
The canonical SMILES for 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide is CC(C)(C)c1ccc(C(=O)NCC(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide?
The InChIKey is RFDMTNIGDKTKCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-17(2,3)14-6-4-13(5-7-14)16(21)18-12-15(20)19-8-10-22-11-9-19/h4-7H,8-12H2,1-3H3,(H,18,21).
What are the key properties of 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide?
4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide has a molecular weight of 304.39 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide is sourced from PubChem (CID 27258300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).