N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide

C21H27N3O2 — CID 109036145

IUPACN-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide
SMILESCCc1ccccc1NC(=O)CCNc1ccccc1N1CCOCC1
InChIInChI=1S/C21H27N3O2/c1-2-17-7-3-4-8-18(17)23-21(25)11-12-22-19-9-5-6-10-20(19)24-13-15-26-16-14-24/h3-10,22H,2,11-16H2,1H3,(H,23,25)
InChIKeyLXJYEDCKFKZMJI-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.53
Rot. Bonds7

About N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide

N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide (PubChem CID 109036145) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide
PubChem CID109036145
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC NameN-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide
SMILESCCc1ccccc1NC(=O)CCNc1ccccc1N1CCOCC1
InChIInChI=1S/C21H27N3O2/c1-2-17-7-3-4-8-18(17)23-21(25)11-12-22-19-9-5-6-10-20(19)24-13-15-26-16-14-24/h3-10,22H,2,11-16H2,1H3,(H,23,25)
InChIKeyLXJYEDCKFKZMJI-UHFFFAOYSA-N
XLogP3.53
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide 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

3-(2-tert-butylanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109037337
N-(2-morpholin-4-ylphenyl)-3-(2,4,6-trimethylanilino)propanamide
CID 109037056
N-(2-methoxyethyl)-3-(2-morpholin-4-ylanilino)propanamide
CID 109015107
N-(2-ethylphenyl)-3-(2-morpholin-4-ylethylamino)propanamide
CID 109016771
1-N-(2-ethylphenyl)-1-N'-(2-morpholin-4-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981735
1-(2-morpholin-4-ylphenyl)-3-propylurea
CID 110755134
3-[(2-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)propanamide
CID 109022218
N-cycloheptyl-3-(2-morpholin-4-ylanilino)propanamide
CID 109031514
3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109039568
4-(4-ethylphenyl)-N-(2-morpholin-4-ylphenyl)-4-oxobutanamide
CID 51157407
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
2-(2-aminophenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 28712686

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide?
The IUPAC name of N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide (CID 109036145) is N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide.
What is the SMILES notation for N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide?
The canonical SMILES for N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide is CCc1ccccc1NC(=O)CCNc1ccccc1N1CCOCC1.
What is the InChIKey of N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide?
The InChIKey is LXJYEDCKFKZMJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-2-17-7-3-4-8-18(17)23-21(25)11-12-22-19-9-5-6-10-20(19)24-13-15-26-16-14-24/h3-10,22H,2,11-16H2,1H3,(H,23,25).
What are the key properties of N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide?
N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide has a molecular weight of 353.47 g/mol, XLogP of 3.53, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide is sourced from PubChem (CID 109036145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).