2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide

C22H28N2O3 — CID 51866530

IUPAC2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide
SMILESCOc1ccccc1C(=O)NCCCCN1CCO[C@H](c2ccccc2)C1
InChIInChI=1S/C22H28N2O3/c1-26-20-12-6-5-11-19(20)22(25)23-13-7-8-14-24-15-16-27-21(17-24)18-9-3-2-4-10-18/h2-6,9-12,21H,7-8,13-17H2,1H3,(H,23,25)/t21-/m0/s1
InChIKeyFQDUZIWCLHVMCU-NRFANRHFSA-N
MW368.48 g/mol
LogP3.28
Rot. Bonds8

About 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide

2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide (PubChem CID 51866530) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide
PubChem CID51866530
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide
SMILESCOc1ccccc1C(=O)NCCCCN1CCO[C@H](c2ccccc2)C1
InChIInChI=1S/C22H28N2O3/c1-26-20-12-6-5-11-19(20)22(25)23-13-7-8-14-24-15-16-27-21(17-24)18-9-3-2-4-10-18/h2-6,9-12,21H,7-8,13-17H2,1H3,(H,23,25)/t21-/m0/s1
InChIKeyFQDUZIWCLHVMCU-NRFANRHFSA-N
XLogP3.28
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4,5-dimethoxy-2-nitro-N-[4-(2-phenylmorpholin-4-yl)butyl]benzamide
CID 16892622
3,4-dimethoxy-N-[3-(2-phenylmorpholin-4-yl)propyl]benzamide
CID 16892558
4-methoxy-N-[3-[(2S)-2-phenylmorpholin-4-yl]propyl]benzamide
CID 27441296
2-nitro-N-[4-(2-phenylmorpholin-4-yl)butyl]benzamide
CID 16892632
2-chloro-N-[2-[(2S)-2-phenylmorpholin-4-yl]ethyl]benzamide
CID 51866428
4-ethoxy-N-[4-(2-phenylmorpholin-4-yl)butyl]benzamide
CID 16892642
4-ethoxy-N-[4-[(2S)-2-phenylmorpholin-4-yl]butyl]benzamide
CID 51866537
4-bromo-N-[4-(2-phenylmorpholin-4-yl)butyl]benzamide
CID 16892637
3-fluoro-N-[4-(2-phenylmorpholin-4-yl)butyl]benzamide
CID 16892619
N-[4-(2-phenylmorpholin-4-yl)butyl]-4-propylbenzamide
CID 16892629
2-methoxy-N-[4-(4-methylpiperazin-1-yl)butyl]benzamide
CID 47029114
3-chloro-N-[4-[(2S)-2-phenylmorpholin-4-yl]butyl]benzamide
CID 51866535

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide?
The IUPAC name of 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide (CID 51866530) is 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide?
The canonical SMILES for 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide is COc1ccccc1C(=O)NCCCCN1CCO[C@H](c2ccccc2)C1.
What is the InChIKey of 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide?
The InChIKey is FQDUZIWCLHVMCU-NRFANRHFSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-26-20-12-6-5-11-19(20)22(25)23-13-7-8-14-24-15-16-27-21(17-24)18-9-3-2-4-10-18/h2-6,9-12,21H,7-8,13-17H2,1H3,(H,23,25)/t21-/m0/s1.
What are the key properties of 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide?
2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide has a molecular weight of 368.48 g/mol, XLogP of 3.28, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]benzamide is sourced from PubChem (CID 51866530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).