(2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone

C24H22F2N2O2 — CID 112843416

IUPAC(2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1Nc1ccccc1)N1CCC(Oc2ccc(F)cc2F)CC1
InChIInChI=1S/C24H22F2N2O2/c25-17-10-11-23(21(26)16-17)30-19-12-14-28(15-13-19)24(29)20-8-4-5-9-22(20)27-18-6-2-1-3-7-18/h1-11,16,19,27H,12-15H2
InChIKeyZUVGEXMMGOHLRJ-UHFFFAOYSA-N
MW408.45 g/mol
LogP5.39
Rot. Bonds5

About (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone

(2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone (PubChem CID 112843416) has the molecular formula C24H22F2N2O2 and a molecular weight of 408.45 g/mol. Its IUPAC name is (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone
PubChem CID112843416
Molecular FormulaC24H22F2N2O2
Molecular Weight408.45 g/mol
Exact Mass408.16
IUPAC Name(2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1Nc1ccccc1)N1CCC(Oc2ccc(F)cc2F)CC1
InChIInChI=1S/C24H22F2N2O2/c25-17-10-11-23(21(26)16-17)30-19-12-14-28(15-13-19)24(29)20-8-4-5-9-22(20)27-18-6-2-1-3-7-18/h1-11,16,19,27H,12-15H2
InChIKeyZUVGEXMMGOHLRJ-UHFFFAOYSA-N
XLogP5.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.45
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone 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

N-[2-[4-(2,4-difluorophenoxy)piperidine-1-carbonyl]phenyl]methanesulfonamide
CID 112843501
(2-aminophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone
CID 119944781
[4-(2,4-difluorophenoxy)piperidin-1-yl]-[2-[(4-fluorophenyl)methoxy]phenyl]methanone
CID 112836609
(2-bromo-5-fluorophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone
CID 112836700
[2-[4-(2,4-difluorophenoxy)piperidine-1-carbonyl]phenyl]-(4-methylphenyl)methanone
CID 112843502
N-(2-anilinophenyl)-1-(2,4-difluorobenzoyl)piperidine-4-carboxamide
CID 112772245
(4-aminopiperidin-1-yl)-(2-anilinophenyl)methanone
CID 119373306
[4-(2-anilinobenzoyl)piperazin-1-yl]-(3,4-difluorophenyl)methanone
CID 46399270
(2-anilinophenyl)-(azepan-1-yl)methanone
CID 25352843
[4-(2,4-difluorophenoxy)piperidin-1-yl]-(3,5-dimethyl-1-phenylpyrazol-4-yl)methanone
CID 112843442
3-[[4-(2,4-difluorophenoxy)piperidine-1-carbonyl]amino]propanoic acid
CID 122019186
5-[4-(2,4-difluorophenoxy)piperidine-1-carbonyl]-2-phenyl-3,4-dihydropyrazole-3-carboxamide
CID 112836577

Frequently Asked Questions

What is the IUPAC name of (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone?
The IUPAC name of (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone (CID 112843416) is (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone.
What is the SMILES notation for (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone?
The canonical SMILES for (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone is O=C(c1ccccc1Nc1ccccc1)N1CCC(Oc2ccc(F)cc2F)CC1.
What is the InChIKey of (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone?
The InChIKey is ZUVGEXMMGOHLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22F2N2O2/c25-17-10-11-23(21(26)16-17)30-19-12-14-28(15-13-19)24(29)20-8-4-5-9-22(20)27-18-6-2-1-3-7-18/h1-11,16,19,27H,12-15H2.
What are the key properties of (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone?
(2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone has a molecular weight of 408.45 g/mol, XLogP of 5.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-anilinophenyl)-[4-(2,4-difluorophenoxy)piperidin-1-yl]methanone is sourced from PubChem (CID 112843416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).