2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide

C21H24ClFN2O2 — CID 47067089

IUPAC2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide
SMILESO=C(COCc1ccccc1Cl)NC1CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C21H24ClFN2O2/c22-19-7-3-1-6-17(19)14-27-15-21(26)24-18-9-11-25(12-10-18)13-16-5-2-4-8-20(16)23/h1-8,18H,9-15H2,(H,24,26)
InChIKeyHXLAYCYLTCBDGH-UHFFFAOYSA-N
MW390.89 g/mol
LogP3.78
Rot. Bonds7

About 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide

2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide (PubChem CID 47067089) has the molecular formula C21H24ClFN2O2 and a molecular weight of 390.89 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide
PubChem CID47067089
Molecular FormulaC21H24ClFN2O2
Molecular Weight390.89 g/mol
Exact Mass390.15
IUPAC Name2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide
SMILESO=C(COCc1ccccc1Cl)NC1CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C21H24ClFN2O2/c22-19-7-3-1-6-17(19)14-27-15-21(26)24-18-9-11-25(12-10-18)13-16-5-2-4-8-20(16)23/h1-8,18H,9-15H2,(H,24,26)
InChIKeyHXLAYCYLTCBDGH-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.89
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-chlorophenyl)methoxy]-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]acetamide
CID 47057697
2-[(2-chlorophenyl)methoxy]-N-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]acetamide
CID 55777562
4-chloro-1-[(2-fluorophenyl)methyl]piperidine
CID 63389364
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-(2-fluorophenoxy)acetamide
CID 8590108
N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]-3-(4-fluorophenyl)sulfanylpropanamide
CID 51123737
2-chloro-6-fluoro-N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]benzamide
CID 55979355
(2R)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]-2-methylsulfonylpropanamide
CID 94797005
1-[(2-chlorophenyl)methyl]-N-cyclopentylpiperidine-4-carboxamide;oxalic acid
CID 2903315
N-(1-benzylpiperidin-4-yl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 17250306
2-(2-chlorophenyl)-N-[1-(cyanomethyl)piperidin-4-yl]acetamide
CID 63626961
2-[(2-chlorophenyl)methoxy]-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95138698
2-[(2S,5R)-5-(acetamidomethyl)-1-methylpyrrolidin-2-yl]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 166620548

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide (CID 47067089) is 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide is O=C(COCc1ccccc1Cl)NC1CCN(Cc2ccccc2F)CC1.
What is the InChIKey of 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide?
The InChIKey is HXLAYCYLTCBDGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClFN2O2/c22-19-7-3-1-6-17(19)14-27-15-21(26)24-18-9-11-25(12-10-18)13-16-5-2-4-8-20(16)23/h1-8,18H,9-15H2,(H,24,26).
What are the key properties of 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide?
2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide has a molecular weight of 390.89 g/mol, XLogP of 3.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methoxy]-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 47067089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).