N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide

C20H22N2O3 — CID 86790082

IUPACN-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide
SMILESO=CNc1ccc(C(=O)N2CCOC(CCc3ccccc3)C2)cc1
InChIInChI=1S/C20H22N2O3/c23-15-21-18-9-7-17(8-10-18)20(24)22-12-13-25-19(14-22)11-6-16-4-2-1-3-5-16/h1-5,7-10,15,19H,6,11-14H2,(H,21,23)
InChIKeyANEANXINBYIFII-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.73
Rot. Bonds6

About N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide

N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide (PubChem CID 86790082) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide.

Molecular Properties

Compound NameN-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide
PubChem CID86790082
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide
SMILESO=CNc1ccc(C(=O)N2CCOC(CCc3ccccc3)C2)cc1
InChIInChI=1S/C20H22N2O3/c23-15-21-18-9-7-17(8-10-18)20(24)22-12-13-25-19(14-22)11-6-16-4-2-1-3-5-16/h1-5,7-10,15,19H,6,11-14H2,(H,21,23)
InChIKeyANEANXINBYIFII-UHFFFAOYSA-N
XLogP2.73
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide 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-(dimethylamino)phenyl]-[(2S)-2-(2-phenylethyl)morpholin-4-yl]methanone
CID 25274863
[3-(dimethylamino)phenyl]-[2-(2-phenylethyl)morpholin-4-yl]methanone
CID 45193768
1-[(2S)-2-(2-phenylethyl)morpholin-4-yl]propan-1-one
CID 95968357
N,N-dimethyl-2-(2-phenylethyl)morpholine-4-carboxamide
CID 75521628
4-oxo-4-[2-(2-phenylethyl)morpholin-4-yl]butanoic acid
CID 120550207
(2-methylfuran-3-yl)-[2-(2-phenylethyl)morpholin-4-yl]methanone
CID 75504750
N-(oxan-4-yl)-2-(2-phenylethyl)morpholine-4-carboxamide
CID 126776750
[(2S)-2-(2-phenylethyl)morpholin-4-yl]-pyrazin-2-ylmethanone
CID 95969181
oxan-4-yl-[(2R)-2-(2-phenylethyl)morpholin-4-yl]methanone
CID 25457524
[(2R)-2-(3-phenylpropyl)morpholin-4-yl]-pyridin-3-ylmethanone
CID 42377336
[(2S)-2-(fluoromethyl)morpholin-4-yl]-phenylmethanone
CID 129348847
2-[2-oxo-2-[2-(2-phenylethyl)morpholin-4-yl]ethyl]benzoic acid
CID 120550218

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide?
The IUPAC name of N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide (CID 86790082) is N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide.
What is the SMILES notation for N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide?
The canonical SMILES for N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide is O=CNc1ccc(C(=O)N2CCOC(CCc3ccccc3)C2)cc1.
What is the InChIKey of N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide?
The InChIKey is ANEANXINBYIFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c23-15-21-18-9-7-17(8-10-18)20(24)22-12-13-25-19(14-22)11-6-16-4-2-1-3-5-16/h1-5,7-10,15,19H,6,11-14H2,(H,21,23).
What are the key properties of N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide?
N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide has a molecular weight of 338.41 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]phenyl]formamide is sourced from PubChem (CID 86790082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).