2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide

C17H23FN2O3 — CID 46983091

IUPAC2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide
SMILESCCCC1COCCN1C(=O)CCNC(=O)c1ccccc1F
InChIInChI=1S/C17H23FN2O3/c1-2-5-13-12-23-11-10-20(13)16(21)8-9-19-17(22)14-6-3-4-7-15(14)18/h3-4,6-7,13H,2,5,8-12H2,1H3,(H,19,22)
InChIKeyDRIVGRLQMGOCGS-UHFFFAOYSA-N
MW322.38 g/mol
LogP1.97
Rot. Bonds6

About 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide

2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide (PubChem CID 46983091) has the molecular formula C17H23FN2O3 and a molecular weight of 322.38 g/mol. Its IUPAC name is 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide
PubChem CID46983091
Molecular FormulaC17H23FN2O3
Molecular Weight322.38 g/mol
Exact Mass322.17
IUPAC Name2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide
SMILESCCCC1COCCN1C(=O)CCNC(=O)c1ccccc1F
InChIInChI=1S/C17H23FN2O3/c1-2-5-13-12-23-11-10-20(13)16(21)8-9-19-17(22)14-6-3-4-7-15(14)18/h3-4,6-7,13H,2,5,8-12H2,1H3,(H,19,22)
InChIKeyDRIVGRLQMGOCGS-UHFFFAOYSA-N
XLogP1.97
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.38
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-fluorophenyl)-[3-(hydroxymethyl)morpholin-4-yl]methanone
CID 69058576
2-fluoro-N-[2-(3-methylmorpholin-4-yl)sulfonylethyl]benzamide
CID 110345598
2-fluoro-N-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]benzamide
CID 46993248
N-[3-[ethyl(oxan-4-ylmethyl)amino]-3-oxopropyl]-2-fluorobenzamide
CID 50975562
3-[3-oxo-3-[(3R)-3-propylmorpholin-4-yl]propyl]quinazolin-4-one
CID 95209616
4-fluoro-3-(3-propylmorpholine-4-carbonyl)benzenesulfonamide
CID 56862071
N-[3-(2-ethylpiperidin-1-yl)-3-oxopropyl]-2,4-difluorobenzamide
CID 51192558
2-fluoro-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460592
N-[2-(1,3-dioxan-2-yl)ethyl]-2-fluorobenzamide
CID 110370059
2-fluoro-N-[3-oxo-3-(3-phenoxypyrrolidin-1-yl)propyl]benzamide
CID 118778125
3-(furan-2-yl)-1-[3-(2-methoxyethyl)morpholin-4-yl]propan-1-one
CID 136544071
2-fluoro-N-[2-[2-(hydroxymethyl)piperidin-1-yl]-2-oxoethyl]benzamide
CID 43421664

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide?
The IUPAC name of 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide (CID 46983091) is 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide?
The canonical SMILES for 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide is CCCC1COCCN1C(=O)CCNC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide?
The InChIKey is DRIVGRLQMGOCGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O3/c1-2-5-13-12-23-11-10-20(13)16(21)8-9-19-17(22)14-6-3-4-7-15(14)18/h3-4,6-7,13H,2,5,8-12H2,1H3,(H,19,22).
What are the key properties of 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide?
2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide has a molecular weight of 322.38 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[3-oxo-3-(3-propylmorpholin-4-yl)propyl]benzamide is sourced from PubChem (CID 46983091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).