N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide

C21H26N2O3 — CID 134015077

IUPACN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide
SMILESO=C(COCc1ccccc1)NCc1ccccc1CN1CCOCC1
InChIInChI=1S/C21H26N2O3/c24-21(17-26-16-18-6-2-1-3-7-18)22-14-19-8-4-5-9-20(19)15-23-10-12-25-13-11-23/h1-9H,10-17H2,(H,22,24)
InChIKeyPCWNQKSUDFPAHG-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.35
Rot. Bonds8

About N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide

N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide (PubChem CID 134015077) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide
PubChem CID134015077
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC NameN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide
SMILESO=C(COCc1ccccc1)NCc1ccccc1CN1CCOCC1
InChIInChI=1S/C21H26N2O3/c24-21(17-26-16-18-6-2-1-3-7-18)22-14-19-8-4-5-9-20(19)15-23-10-12-25-13-11-23/h1-9H,10-17H2,(H,22,24)
InChIKeyPCWNQKSUDFPAHG-UHFFFAOYSA-N
XLogP2.35
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide?
The IUPAC name of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide (CID 134015077) is N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide.
What is the SMILES notation for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide?
The canonical SMILES for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide is O=C(COCc1ccccc1)NCc1ccccc1CN1CCOCC1.
What is the InChIKey of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide?
The InChIKey is PCWNQKSUDFPAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c24-21(17-26-16-18-6-2-1-3-7-18)22-14-19-8-4-5-9-20(19)15-23-10-12-25-13-11-23/h1-9H,10-17H2,(H,22,24).
What are the key properties of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide?
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide has a molecular weight of 354.45 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide is sourced from PubChem (CID 134015077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).