2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride

C18H28Cl2FN3O2 — CID 119460909

IUPAC2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
SMILESCl.Cl.O=C(NCC1CCCNC1)C(c1ccccc1F)N1CCOCC1
InChIInChI=1S/C18H26FN3O2.2ClH/c19-16-6-2-1-5-15(16)17(22-8-10-24-11-9-22)18(23)21-13-14-4-3-7-20-12-14;;/h1-2,5-6,14,17,20H,3-4,7-13H2,(H,21,23);2*1H
InChIKeyHGPAZJYYXMCFIW-UHFFFAOYSA-N
MW408.35 g/mol
LogP2.16
Rot. Bonds5

About 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride

2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride (PubChem CID 119460909) has the molecular formula C18H28Cl2FN3O2 and a molecular weight of 408.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
PubChem CID119460909
Molecular FormulaC18H28Cl2FN3O2
Molecular Weight408.35 g/mol
Exact Mass407.15
IUPAC Name2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
SMILESCl.Cl.O=C(NCC1CCCNC1)C(c1ccccc1F)N1CCOCC1
InChIInChI=1S/C18H26FN3O2.2ClH/c19-16-6-2-1-5-15(16)17(22-8-10-24-11-9-22)18(23)21-13-14-4-3-7-20-12-14;;/h1-2,5-6,14,17,20H,3-4,7-13H2,(H,21,23);2*1H
InChIKeyHGPAZJYYXMCFIW-UHFFFAOYSA-N
XLogP2.16
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.35
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)-N-[2-(methylamino)propyl]-2-morpholin-4-ylacetamide
CID 120826501
1-(2,6-difluorophenyl)-3-(piperidin-3-ylmethyl)urea;hydrochloride
CID 165430548
3-(2-fluorophenyl)sulfanyl-N-(piperidin-3-ylmethyl)propanamide
CID 119462366
(2R)-2-(2-fluorophenyl)-1-[(3S)-3-(methylaminomethyl)pyrrolidin-1-yl]-2-morpholin-4-ylethanone
CID 124612695
2-(2,4-difluorophenyl)sulfanyl-2-phenyl-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119463362
N-(piperidin-3-ylmethyl)-3-[2-(trifluoromethyl)phenyl]butanamide;hydrochloride
CID 119464051
2-(2-fluorophenyl)-2-morpholin-4-yl-N-(4,5,6,7-tetrahydro-1H-indazol-6-yl)acetamide
CID 127463357
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
2-morpholin-4-yl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
CID 119461977
(2S)-2-(2-fluorophenyl)-1-[(3R)-3-methylpiperazin-1-yl]-2-morpholin-4-ylethanone
CID 124591150
2-phenoxy-2-phenyl-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119461962
2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
CID 166436266

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
The IUPAC name of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride (CID 119460909) is 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride.
What is the SMILES notation for 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
The canonical SMILES for 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride is Cl.Cl.O=C(NCC1CCCNC1)C(c1ccccc1F)N1CCOCC1.
What is the InChIKey of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
The InChIKey is HGPAZJYYXMCFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN3O2.2ClH/c19-16-6-2-1-5-15(16)17(22-8-10-24-11-9-22)18(23)21-13-14-4-3-7-20-12-14;;/h1-2,5-6,14,17,20H,3-4,7-13H2,(H,21,23);2*1H.
What are the key properties of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride has a molecular weight of 408.35 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride is sourced from PubChem (CID 119460909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).