2-[4-(difluoromethyl)phenyl]-6-methylmorpholine

C12H15F2NO — CID 115525669

IUPAC2-[4-(difluoromethyl)phenyl]-6-methylmorpholine
SMILESCC1CNCC(c2ccc(C(F)F)cc2)O1
InChIInChI=1S/C12H15F2NO/c1-8-6-15-7-11(16-8)9-2-4-10(5-3-9)12(13)14/h2-5,8,11-12,15H,6-7H2,1H3
InChIKeyMAVOZMHWKRSIIQ-UHFFFAOYSA-N
MW227.25 g/mol
LogP2.67
Rot. Bonds2

About 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine

2-[4-(difluoromethyl)phenyl]-6-methylmorpholine (PubChem CID 115525669) has the molecular formula C12H15F2NO and a molecular weight of 227.25 g/mol. Its IUPAC name is 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine.

Molecular Properties

Compound Name2-[4-(difluoromethyl)phenyl]-6-methylmorpholine
PubChem CID115525669
Molecular FormulaC12H15F2NO
Molecular Weight227.25 g/mol
Exact Mass227.11
IUPAC Name2-[4-(difluoromethyl)phenyl]-6-methylmorpholine
SMILESCC1CNCC(c2ccc(C(F)F)cc2)O1
InChIInChI=1S/C12H15F2NO/c1-8-6-15-7-11(16-8)9-2-4-10(5-3-9)12(13)14/h2-5,8,11-12,15H,6-7H2,1H3
InChIKeyMAVOZMHWKRSIIQ-UHFFFAOYSA-N
XLogP2.67
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine 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

(2S,6S)-2-methyl-6-phenylmorpholine
CID 36689632
2-methyl-6-(4-phenylphenyl)morpholine
CID 43367004
2-methyl-6-[4-[(2-methylpropan-2-yl)oxy]phenyl]morpholine
CID 82297062
(2S,6S)-2-(3-chlorophenyl)-6-methylmorpholine
CID 39243005
(2R,6R)-2-(3-chlorophenyl)-6-methylmorpholine
CID 39242999
(2S,6R)-2-methyl-6-(2-methyl-4-pyridinyl)morpholine
CID 170711883
3-(fluoroamino)-N-[4-[(2S,6R)-6-methylmorpholin-2-yl]phenyl]propanamide
CID 145006151
(2S,6R)-2-methyl-6-(1-methylpyrazol-4-yl)morpholine
CID 177322255
3-(6-methylmorpholin-2-yl)benzonitrile
CID 63991339
N-(4-bromophenyl)-4-[(2S,6R)-6-methylmorpholin-2-yl]benzamide
CID 129145042
2-methyl-6-(2-methylphenyl)morpholine
CID 43367022
2,6-diphenylmorpholine
CID 43381979

Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine?
The IUPAC name of 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine (CID 115525669) is 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine.
What is the SMILES notation for 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine?
The canonical SMILES for 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine is CC1CNCC(c2ccc(C(F)F)cc2)O1.
What is the InChIKey of 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine?
The InChIKey is MAVOZMHWKRSIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2NO/c1-8-6-15-7-11(16-8)9-2-4-10(5-3-9)12(13)14/h2-5,8,11-12,15H,6-7H2,1H3.
What are the key properties of 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine?
2-[4-(difluoromethyl)phenyl]-6-methylmorpholine has a molecular weight of 227.25 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethyl)phenyl]-6-methylmorpholine is sourced from PubChem (CID 115525669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).