[1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone

C17H20F2N2O4 — CID 86861625

IUPAC[1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1c(O)cc(F)cc1F)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C17H20F2N2O4/c18-12-8-13(19)15(14(22)9-12)17(24)21-3-1-2-11(10-21)16(23)20-4-6-25-7-5-20/h8-9,11,22H,1-7,10H2
InChIKeyBNVZZPQJWHBXRS-UHFFFAOYSA-N
MW354.35 g/mol
LogP1.38
Rot. Bonds2

About [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone

[1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone (PubChem CID 86861625) has the molecular formula C17H20F2N2O4 and a molecular weight of 354.35 g/mol. Its IUPAC name is [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
PubChem CID86861625
Molecular FormulaC17H20F2N2O4
Molecular Weight354.35 g/mol
Exact Mass354.14
IUPAC Name[1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1c(O)cc(F)cc1F)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C17H20F2N2O4/c18-12-8-13(19)15(14(22)9-12)17(24)21-3-1-2-11(10-21)16(23)20-4-6-25-7-5-20/h8-9,11,22H,1-7,10H2
InChIKeyBNVZZPQJWHBXRS-UHFFFAOYSA-N
XLogP1.38
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.35
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone 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

[1-(2-chloro-4-fluorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 51329356
morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
CID 31006642
[1-(4-aminobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 119700503
[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 51326639
[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 936701
[(3R)-1-(3-fluorobenzoyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 932369
[1-(3-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 3769094
[1-[4-(aminomethyl)benzoyl]piperidin-3-yl]-morpholin-4-ylmethanone;hydrochloride
CID 119277068
[1-(5-methylpyrazine-2-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 42783455
[1-[(4-fluorophenyl)methyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 43918724
morpholin-4-yl-[1-[2-(trifluoromethyl)benzoyl]piperidin-3-yl]methanone
CID 55517643
morpholin-4-yl-[(3S)-1-[4-(1,2,4-triazol-4-yl)benzoyl]piperidin-3-yl]methanone
CID 124568573

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone (CID 86861625) is [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone is O=C(c1c(O)cc(F)cc1F)N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is BNVZZPQJWHBXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20F2N2O4/c18-12-8-13(19)15(14(22)9-12)17(24)21-3-1-2-11(10-21)16(23)20-4-6-25-7-5-20/h8-9,11,22H,1-7,10H2.
What are the key properties of [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
[1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 354.35 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-difluoro-6-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 86861625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).