2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide

C17H26N2O2 — CID 110637243

IUPAC2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(N2CCOC(C)C2)cc1
InChIInChI=1S/C17H26N2O2/c1-4-14(5-2)17(20)18-15-6-8-16(9-7-15)19-10-11-21-13(3)12-19/h6-9,13-14H,4-5,10-12H2,1-3H3,(H,18,20)
InChIKeyMDAFOHGZCAELHR-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.29
Rot. Bonds5

About 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide

2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide (PubChem CID 110637243) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide
PubChem CID110637243
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(N2CCOC(C)C2)cc1
InChIInChI=1S/C17H26N2O2/c1-4-14(5-2)17(20)18-15-6-8-16(9-7-15)19-10-11-21-13(3)12-19/h6-9,13-14H,4-5,10-12H2,1-3H3,(H,18,20)
InChIKeyMDAFOHGZCAELHR-UHFFFAOYSA-N
XLogP3.29
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide 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

2,2-dimethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
CID 110637241
N-[4-(2-methylmorpholin-4-yl)phenyl]-2-phenylacetamide
CID 110637265
4-methyl-N-[4-(2-methylmorpholin-4-yl)phenyl]benzamide
CID 110637249
1-(4-hydroxycyclohexyl)-3-[4-[(2R)-2-methylmorpholin-4-yl]phenyl]urea
CID 95634857
N-[4-(2-methylmorpholin-4-yl)phenyl]ethanesulfonamide
CID 91661182
2-chloro-N-[4-(2-methylmorpholin-4-yl)phenyl]benzamide
CID 110637279
1-[(2R)-2-cyanopropyl]-1-ethyl-3-[4-[(2S)-2-methylmorpholin-4-yl]phenyl]urea
CID 100839373
2-ethyl-N-[4-(4-methylmorpholin-2-yl)phenyl]butanamide
CID 110720339
2-(aminomethyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]butanamide
CID 65228931
3-(4-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
CID 110637300
N-(4-ethylphenyl)-2-(2-methylmorpholin-4-yl)propanamide
CID 46527680
N-[4-(2-methylmorpholin-4-yl)phenyl]-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110637302

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide?
The IUPAC name of 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide (CID 110637243) is 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide?
The canonical SMILES for 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide is CCC(CC)C(=O)Nc1ccc(N2CCOC(C)C2)cc1.
What is the InChIKey of 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide?
The InChIKey is MDAFOHGZCAELHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-14(5-2)17(20)18-15-6-8-16(9-7-15)19-10-11-21-13(3)12-19/h6-9,13-14H,4-5,10-12H2,1-3H3,(H,18,20).
What are the key properties of 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide?
2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide has a molecular weight of 290.41 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]butanamide is sourced from PubChem (CID 110637243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).