N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide

C18H18F2N2O3 — CID 71919695

IUPACN-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide
SMILESCN1CCOC(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)C1
InChIInChI=1S/C18H18F2N2O3/c1-22-6-7-24-17(11-22)18(23)21-15-4-2-3-5-16(15)25-14-9-12(19)8-13(20)10-14/h2-5,8-10,17H,6-7,11H2,1H3,(H,21,23)
InChIKeyIEJBPBLZRAVXIR-UHFFFAOYSA-N
MW348.35 g/mol
LogP3.03
Rot. Bonds4

About N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide

N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide (PubChem CID 71919695) has the molecular formula C18H18F2N2O3 and a molecular weight of 348.35 g/mol. Its IUPAC name is N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide
PubChem CID71919695
Molecular FormulaC18H18F2N2O3
Molecular Weight348.35 g/mol
Exact Mass348.13
IUPAC NameN-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide
SMILESCN1CCOC(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)C1
InChIInChI=1S/C18H18F2N2O3/c1-22-6-7-24-17(11-22)18(23)21-15-4-2-3-5-16(15)25-14-9-12(19)8-13(20)10-14/h2-5,8-10,17H,6-7,11H2,1H3,(H,21,23)
InChIKeyIEJBPBLZRAVXIR-UHFFFAOYSA-N
XLogP3.03
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-N-phenylmorpholine-2-carboxamide
CID 20524995
(2S,5R)-5-(aminomethyl)-N-[2-(3,5-difluorophenoxy)phenyl]oxolane-2-carboxamide;hydrochloride
CID 120796585
N-[2-(3,5-difluorophenoxy)phenyl]-2-hydroxycyclopentane-1-carboxamide
CID 110016234
N-[2-(3,5-difluorophenoxy)phenyl]-3-hydroxypyrrolidine-1-carboxamide
CID 75520270
N-[2-(3-fluorophenoxy)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 60557145
(2S)-N-[3-(2,6-difluorophenyl)-1,2-oxazol-5-yl]-4-methylmorpholine-2-carboxamide
CID 97330305
N-(3-fluoro-4-methylsulfinylphenyl)-4-methylmorpholine-2-carboxamide
CID 75470295
2-(2-aminoethyl)-N-[2-(4-fluorophenoxy)phenyl]morpholine-4-carboxamide
CID 74240763
1-[2-(3,5-difluorophenoxy)phenyl]-3-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea
CID 126772268
N-[2-(3,5-difluorophenoxy)phenyl]pyridazine-4-carboxamide
CID 122133953
2-(2-methylmorpholin-4-yl)-N-(2-phenoxyphenyl)acetamide
CID 46677615
4-[2-(2-methoxyanilino)-2-oxoethyl]-N-methylmorpholine-2-carboxamide
CID 166601947

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide?
The IUPAC name of N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide (CID 71919695) is N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide.
What is the SMILES notation for N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide?
The canonical SMILES for N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide is CN1CCOC(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)C1.
What is the InChIKey of N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide?
The InChIKey is IEJBPBLZRAVXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O3/c1-22-6-7-24-17(11-22)18(23)21-15-4-2-3-5-16(15)25-14-9-12(19)8-13(20)10-14/h2-5,8-10,17H,6-7,11H2,1H3,(H,21,23).
What are the key properties of N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide?
N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide has a molecular weight of 348.35 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-difluorophenoxy)phenyl]-4-methylmorpholine-2-carboxamide is sourced from PubChem (CID 71919695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).