1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride

C17H24ClFN2O2 — CID 119799317

IUPAC1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
SMILESCC1CN(C(=O)CC2CCCN2)CC(c2ccc(F)cc2)O1.Cl
InChIInChI=1S/C17H23FN2O2.ClH/c1-12-10-20(17(21)9-15-3-2-8-19-15)11-16(22-12)13-4-6-14(18)7-5-13;/h4-7,12,15-16,19H,2-3,8-11H2,1H3;1H
InChIKeySTRFDZIPNCQKKQ-UHFFFAOYSA-N
MW342.84 g/mol
LogP2.68
Rot. Bonds3

About 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride

1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride (PubChem CID 119799317) has the molecular formula C17H24ClFN2O2 and a molecular weight of 342.84 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
PubChem CID119799317
Molecular FormulaC17H24ClFN2O2
Molecular Weight342.84 g/mol
Exact Mass342.15
IUPAC Name1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
SMILESCC1CN(C(=O)CC2CCCN2)CC(c2ccc(F)cc2)O1.Cl
InChIInChI=1S/C17H23FN2O2.ClH/c1-12-10-20(17(21)9-15-3-2-8-19-15)11-16(22-12)13-4-6-14(18)7-5-13;/h4-7,12,15-16,19H,2-3,8-11H2,1H3;1H
InChIKeySTRFDZIPNCQKKQ-UHFFFAOYSA-N
XLogP2.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.84
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride 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-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone
CID 104958689
2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone
CID 110369198
cyclopropyl-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369168
1-[2-(3-fluorophenyl)morpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119770443
1-(2-methylmorpholin-4-yl)-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119698735
(2S)-2-amino-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]propan-1-one
CID 119332587
1-(2-methyl-1,4-oxazepan-4-yl)-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119771971
1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-methyl-3-(methylamino)propan-1-one;hydrochloride
CID 119799303
[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-[4-(methoxymethyl)piperidin-4-yl]methanone;hydrochloride
CID 120635305
(4-chlorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369215
[(2R,6S)-2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 124697908
(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride
CID 119304765

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride?
The IUPAC name of 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride (CID 119799317) is 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride.
What is the SMILES notation for 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride?
The canonical SMILES for 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride is CC1CN(C(=O)CC2CCCN2)CC(c2ccc(F)cc2)O1.Cl.
What is the InChIKey of 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride?
The InChIKey is STRFDZIPNCQKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2.ClH/c1-12-10-20(17(21)9-15-3-2-8-19-15)11-16(22-12)13-4-6-14(18)7-5-13;/h4-7,12,15-16,19H,2-3,8-11H2,1H3;1H.
What are the key properties of 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride?
1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride has a molecular weight of 342.84 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride is sourced from PubChem (CID 119799317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).