N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide

C25H26N2O3 — CID 47776428

IUPACN-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide
SMILESO=C(Nc1cccc(CN2CCOCC2)c1)C(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O3/c28-25(24(21-9-3-1-4-10-21)30-23-12-5-2-6-13-23)26-22-11-7-8-20(18-22)19-27-14-16-29-17-15-27/h1-13,18,24H,14-17,19H2,(H,26,28)
InChIKeyBHTABTAOCDJTAU-UHFFFAOYSA-N
MW402.49 g/mol
LogP4.28
Rot. Bonds7

About N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide

N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide (PubChem CID 47776428) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide.

Molecular Properties

Compound NameN-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide
PubChem CID47776428
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC NameN-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide
SMILESO=C(Nc1cccc(CN2CCOCC2)c1)C(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O3/c28-25(24(21-9-3-1-4-10-21)30-23-12-5-2-6-13-23)26-22-11-7-8-20(18-22)19-27-14-16-29-17-15-27/h1-13,18,24H,14-17,19H2,(H,26,28)
InChIKeyBHTABTAOCDJTAU-UHFFFAOYSA-N
XLogP4.28
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-tert-butylphenoxy)-N-[3-(morpholin-4-ylmethyl)phenyl]propanamide
CID 60585839
N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenoxypropanamide
CID 75814355
(2S)-N-(3-methoxyphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)-2-phenylacetamide
CID 40814254
cis-(1R,2S)-N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenylcyclopropane-1-carboxamide
CID 51699063
[3-(morpholin-4-ylmethyl)phenyl]thiourea
CID 97033783
(2R)-2-[4-[(3-hydroxyphenyl)methyl]piperazin-1-yl]-N-(3-methoxyphenyl)-2-phenylacetamide
CID 95785630
N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide
CID 43908479
2-(4-bromopyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]propanamide
CID 19537582
2-amino-N-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-phenylpropanamide
CID 119902578
5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
CID 19451164
1-cyano-N-[3-(morpholin-4-ylmethyl)phenyl]cyclopentane-1-carboxamide
CID 51096615
N-[3-(morpholin-4-ylmethyl)phenyl]-4-pentoxybenzamide
CID 52751437

Frequently Asked Questions

What is the IUPAC name of N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide?
The IUPAC name of N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide (CID 47776428) is N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide.
What is the SMILES notation for N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide?
The canonical SMILES for N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide is O=C(Nc1cccc(CN2CCOCC2)c1)C(Oc1ccccc1)c1ccccc1.
What is the InChIKey of N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide?
The InChIKey is BHTABTAOCDJTAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c28-25(24(21-9-3-1-4-10-21)30-23-12-5-2-6-13-23)26-22-11-7-8-20(18-22)19-27-14-16-29-17-15-27/h1-13,18,24H,14-17,19H2,(H,26,28).
What are the key properties of N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide?
N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide has a molecular weight of 402.49 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenoxy-2-phenylacetamide is sourced from PubChem (CID 47776428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).