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

C15H21ClF2N2O3 — CID 119716597

IUPACN-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride
SMILESCC(NC(=O)CC1CNCCO1)c1ccccc1OC(F)F.Cl
InChIInChI=1S/C15H20F2N2O3.ClH/c1-10(12-4-2-3-5-13(12)22-15(16)17)19-14(20)8-11-9-18-6-7-21-11;/h2-5,10-11,15,18H,6-9H2,1H3,(H,19,20);1H
InChIKeyGFNKIXJQLFHZQK-UHFFFAOYSA-N
MW350.79 g/mol
LogP2.27
Rot. Bonds6

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

N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride (PubChem CID 119716597) has the molecular formula C15H21ClF2N2O3 and a molecular weight of 350.79 g/mol. Its IUPAC name is N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride
PubChem CID119716597
Molecular FormulaC15H21ClF2N2O3
Molecular Weight350.79 g/mol
Exact Mass350.12
IUPAC NameN-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride
SMILESCC(NC(=O)CC1CNCCO1)c1ccccc1OC(F)F.Cl
InChIInChI=1S/C15H20F2N2O3.ClH/c1-10(12-4-2-3-5-13(12)22-15(16)17)19-14(20)8-11-9-18-6-7-21-11;/h2-5,10-11,15,18H,6-9H2,1H3,(H,19,20);1H
InChIKeyGFNKIXJQLFHZQK-UHFFFAOYSA-N
XLogP2.27
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.79
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
The IUPAC name of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride (CID 119716597) is N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride is CC(NC(=O)CC1CNCCO1)c1ccccc1OC(F)F.Cl.
What is the InChIKey of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
The InChIKey is GFNKIXJQLFHZQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O3.ClH/c1-10(12-4-2-3-5-13(12)22-15(16)17)19-14(20)8-11-9-18-6-7-21-11;/h2-5,10-11,15,18H,6-9H2,1H3,(H,19,20);1H.
What are the key properties of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride has a molecular weight of 350.79 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119716597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).