2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide

C17H24FN3O2 — CID 142832547

IUPAC2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide
SMILESCc1cc(F)ccc1C1CC(N2CCOCC2)CCN1C(N)=O
InChIInChI=1S/C17H24FN3O2/c1-12-10-13(18)2-3-15(12)16-11-14(4-5-21(16)17(19)22)20-6-8-23-9-7-20/h2-3,10,14,16H,4-9,11H2,1H3,(H2,19,22)
InChIKeyALXQVCWEJZUHNL-UHFFFAOYSA-N
MW321.40 g/mol
LogP2.05
Rot. Bonds2

About 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide

2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide (PubChem CID 142832547) has the molecular formula C17H24FN3O2 and a molecular weight of 321.40 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide
PubChem CID142832547
Molecular FormulaC17H24FN3O2
Molecular Weight321.40 g/mol
Exact Mass321.19
IUPAC Name2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide
SMILESCc1cc(F)ccc1C1CC(N2CCOCC2)CCN1C(N)=O
InChIInChI=1S/C17H24FN3O2/c1-12-10-13(18)2-3-15(12)16-11-14(4-5-21(16)17(19)22)20-6-8-23-9-7-20/h2-3,10,14,16H,4-9,11H2,1H3,(H2,19,22)
InChIKeyALXQVCWEJZUHNL-UHFFFAOYSA-N
XLogP2.05
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-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

(2S)-N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide
CID 87610808
ethyl N-[1-carbamoyl-2-(4-fluoro-2-methylphenyl)piperidin-4-yl]carbamate
CID 142832633
(2R,4S)-2-(4-fluoro-2-methylphenyl)-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]piperidine-1-carboxylic acid
CID 21029362
2-(4-fluoro-2-methylphenyl)-4-[[(3S)-3-hydroxybutanoyl]amino]piperidine-1-carboxamide
CID 69462337
(2R,4S)-4-[carbamoyl(methyl)amino]-2-(4-fluoro-2-methylphenyl)piperidine-1-carboxylic acid
CID 68878667
4-[(8aR)-6-oxo-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-2-yl]-2-(4-fluoro-2-methylphenyl)piperidine-1-carboxylic acid
CID 68592432
(2R,4R)-4-[(8aS)-6-oxo-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-2-yl]-2-(4-fluoro-2-methylphenyl)piperidine-1-carboxylic acid
CID 18439814
[1-carbamoyl-2-(4-fluoro-2-methylphenyl)piperidin-4-yl] (2S)-5-oxopyrrolidine-2-carboxylate
CID 154454349
(2R,4S)-4-(dimethylamino)-2-(4-fluoro-2-methylphenyl)piperidine-1-carboxylic acid
CID 68878588
(2R,4S)-4-(azepan-1-yl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(4-fluoro-2-methylphenyl)-N-methylpiperidine-1-carboxamide;(2S,4R)-4-(azepan-1-yl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(4-fluoro-2-methylphenyl)-N-methylpiperidine-1-carboxamide;tetrahydrochloride
CID 162038775
(2R,4R)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(4-cyclopropyl-3-oxopiperazin-1-yl)-2-(4-fluoro-2-methylphenyl)-N-methylpiperidine-1-carboxamide
CID 10196930
(2R,4R)-N-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-N-ethyl-2-(4-fluoro-2-methylphenyl)-4-(4-methylpiperazin-1-yl)piperidine-1-carboxamide
CID 123240462

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide (CID 142832547) is 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide is Cc1cc(F)ccc1C1CC(N2CCOCC2)CCN1C(N)=O.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide?
The InChIKey is ALXQVCWEJZUHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN3O2/c1-12-10-13(18)2-3-15(12)16-11-14(4-5-21(16)17(19)22)20-6-8-23-9-7-20/h2-3,10,14,16H,4-9,11H2,1H3,(H2,19,22).
What are the key properties of 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide?
2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide has a molecular weight of 321.40 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-4-morpholin-4-ylpiperidine-1-carboxamide is sourced from PubChem (CID 142832547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).