N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide

C15H20F2N2O3 — CID 119720082

IUPACN-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide
SMILESCC(NC(=O)CC1CNCCO1)c1cccc(OC(F)F)c1
InChIInChI=1S/C15H20F2N2O3/c1-10(11-3-2-4-12(7-11)22-15(16)17)19-14(20)8-13-9-18-5-6-21-13/h2-4,7,10,13,15,18H,5-6,8-9H2,1H3,(H,19,20)
InChIKeyWZBNPKUOGHOUMZ-UHFFFAOYSA-N
MW314.33 g/mol
LogP1.84
Rot. Bonds6

About N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide

N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide (PubChem CID 119720082) has the molecular formula C15H20F2N2O3 and a molecular weight of 314.33 g/mol. Its IUPAC name is N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide
PubChem CID119720082
Molecular FormulaC15H20F2N2O3
Molecular Weight314.33 g/mol
Exact Mass314.14
IUPAC NameN-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide
SMILESCC(NC(=O)CC1CNCCO1)c1cccc(OC(F)F)c1
InChIInChI=1S/C15H20F2N2O3/c1-10(11-3-2-4-12(7-11)22-15(16)17)19-14(20)8-13-9-18-5-6-21-13/h2-4,7,10,13,15,18H,5-6,8-9H2,1H3,(H,19,20)
InChIKeyWZBNPKUOGHOUMZ-UHFFFAOYSA-N
XLogP1.84
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.33
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(3-bromophenyl)ethyl]-2-morpholin-2-ylacetamide
CID 81376334
2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
CID 119686331
N-[1-(3-acetamidophenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119710822
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119716597
2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 119686106
N-[(1S)-1-(furan-2-yl)ethyl]-2-morpholin-2-ylacetamide
CID 81400402
N-benzhydryl-2-morpholin-2-ylacetamide;hydrochloride
CID 119675556
2-morpholin-2-yl-N-(1-phenylpropyl)acetamide
CID 66427474
2-morpholin-2-yl-N-(4-phenylbutan-2-yl)acetamide
CID 66428944
N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(3-fluorophenyl)acetamide
CID 42961600
1-[1-[3-(difluoromethoxy)phenyl]ethyl]-3-(2-hydroxyethyl)urea
CID 110894255
N-(2,6-dimethylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119676388

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide?
The IUPAC name of N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide (CID 119720082) is N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide?
The canonical SMILES for N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide is CC(NC(=O)CC1CNCCO1)c1cccc(OC(F)F)c1.
What is the InChIKey of N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide?
The InChIKey is WZBNPKUOGHOUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O3/c1-10(11-3-2-4-12(7-11)22-15(16)17)19-14(20)8-13-9-18-5-6-21-13/h2-4,7,10,13,15,18H,5-6,8-9H2,1H3,(H,19,20).
What are the key properties of N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide?
N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide has a molecular weight of 314.33 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide is sourced from PubChem (CID 119720082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).