ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate

C17H25N3O4 — CID 113062485

IUPACethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate
SMILESCCOC(=O)NCCN(C(C)=O)c1ccccc1N1CCOCC1
InChIInChI=1S/C17H25N3O4/c1-3-24-17(22)18-8-9-20(14(2)21)16-7-5-4-6-15(16)19-10-12-23-13-11-19/h4-7H,3,8-13H2,1-2H3,(H,18,22)
InChIKeyDFGFFDWOXBSYNV-UHFFFAOYSA-N
MW335.40 g/mol
LogP1.62
Rot. Bonds6

About ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate

ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate (PubChem CID 113062485) has the molecular formula C17H25N3O4 and a molecular weight of 335.40 g/mol. Its IUPAC name is ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate
PubChem CID113062485
Molecular FormulaC17H25N3O4
Molecular Weight335.40 g/mol
Exact Mass335.18
IUPAC Nameethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate
SMILESCCOC(=O)NCCN(C(C)=O)c1ccccc1N1CCOCC1
InChIInChI=1S/C17H25N3O4/c1-3-24-17(22)18-8-9-20(14(2)21)16-7-5-4-6-15(16)19-10-12-23-13-11-19/h4-7H,3,8-13H2,1-2H3,(H,18,22)
InChIKeyDFGFFDWOXBSYNV-UHFFFAOYSA-N
XLogP1.62
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate 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

ethyl N-[2-(N-acetyl-2-methylanilino)ethyl]carbamate
CID 113057346
3-(N-acetyl-2-morpholin-4-ylanilino)-N-cyclopropylpropanamide
CID 113132150
3-(N-acetyl-2-morpholin-4-ylanilino)-N-(4-methylphenyl)propanamide
CID 113132196
2-(N-acetyl-2-morpholin-4-ylanilino)-N-butyl-N-methylacetamide
CID 113177315
3-(N-acetyl-2-morpholin-4-ylanilino)-N-cyclohexylpropanamide
CID 113132158
2-(N-acetyl-2-morpholin-4-ylanilino)-N-propan-2-ylacetamide
CID 113177265
3-(N-acetyl-2-morpholin-4-ylanilino)-N-(pyridin-3-ylmethyl)propanamide
CID 113132180
ethyl N-[2-[acetyl(1,3-benzodioxol-5-yl)amino]ethyl]carbamate
CID 113062992
ethyl N-[2-(N-acetyl-4-chloro-2-methylanilino)ethyl]carbamate
CID 113059937
ethyl N-[2-(N-acetyl-5-chloro-2-methoxyanilino)ethyl]carbamate
CID 113060315
3-(N-acetyl-2-fluoroanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 113126781
methyl N-[2-(N-acetyl-2-methoxyanilino)ethyl]carbamate
CID 113060483

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate?
The IUPAC name of ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate (CID 113062485) is ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate?
The canonical SMILES for ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate is CCOC(=O)NCCN(C(C)=O)c1ccccc1N1CCOCC1.
What is the InChIKey of ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate?
The InChIKey is DFGFFDWOXBSYNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O4/c1-3-24-17(22)18-8-9-20(14(2)21)16-7-5-4-6-15(16)19-10-12-23-13-11-19/h4-7H,3,8-13H2,1-2H3,(H,18,22).
What are the key properties of ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate?
ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate has a molecular weight of 335.40 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(N-acetyl-2-morpholin-4-ylanilino)ethyl]carbamate is sourced from PubChem (CID 113062485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).