N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide

C21H25ClN2O2 — CID 37050457

IUPACN-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC[C@@H](c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C21H25ClN2O2/c22-19-9-5-4-8-18(19)20(24-12-14-26-15-13-24)16-23-21(25)11-10-17-6-2-1-3-7-17/h1-9,20H,10-16H2,(H,23,25)/t20-/m0/s1
InChIKeyOWDQBHDEUSSHFR-FQEVSTJZSA-N
MW372.90 g/mol
LogP3.46
Rot. Bonds7

About N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide

N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide (PubChem CID 37050457) has the molecular formula C21H25ClN2O2 and a molecular weight of 372.90 g/mol. Its IUPAC name is N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide
PubChem CID37050457
Molecular FormulaC21H25ClN2O2
Molecular Weight372.90 g/mol
Exact Mass372.16
IUPAC NameN-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC[C@@H](c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C21H25ClN2O2/c22-19-9-5-4-8-18(19)20(24-12-14-26-15-13-24)16-23-21(25)11-10-17-6-2-1-3-7-17/h1-9,20H,10-16H2,(H,23,25)/t20-/m0/s1
InChIKeyOWDQBHDEUSSHFR-FQEVSTJZSA-N
XLogP3.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.90
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide?
The IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide (CID 37050457) is N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide?
The canonical SMILES for N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide is O=C(CCc1ccccc1)NC[C@@H](c1ccccc1Cl)N1CCOCC1.
What is the InChIKey of N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide?
The InChIKey is OWDQBHDEUSSHFR-FQEVSTJZSA-N. The full InChI is InChI=1S/C21H25ClN2O2/c22-19-9-5-4-8-18(19)20(24-12-14-26-15-13-24)16-23-21(25)11-10-17-6-2-1-3-7-17/h1-9,20H,10-16H2,(H,23,25)/t20-/m0/s1.
What are the key properties of N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide?
N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide has a molecular weight of 372.90 g/mol, XLogP of 3.46, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide is sourced from PubChem (CID 37050457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).