3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide

C18H18FN3O4 — CID 131932108

IUPAC3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccncc1F
InChIInChI=1S/C18H18FN3O4/c19-16-11-20-6-5-15(16)18(24)21-13-1-3-14(4-2-13)26-12-17(23)22-7-9-25-10-8-22/h1-6,11H,7-10,12H2,(H,21,24)
InChIKeySTPBEGGDFRGUTL-UHFFFAOYSA-N
MW359.36 g/mol
LogP1.71
Rot. Bonds5

About 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide

3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide (PubChem CID 131932108) has the molecular formula C18H18FN3O4 and a molecular weight of 359.36 g/mol. Its IUPAC name is 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide
PubChem CID131932108
Molecular FormulaC18H18FN3O4
Molecular Weight359.36 g/mol
Exact Mass359.13
IUPAC Name3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccncc1F
InChIInChI=1S/C18H18FN3O4/c19-16-11-20-6-5-15(16)18(24)21-13-1-3-14(4-2-13)26-12-17(23)22-7-9-25-10-8-22/h1-6,11H,7-10,12H2,(H,21,24)
InChIKeySTPBEGGDFRGUTL-UHFFFAOYSA-N
XLogP1.71
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.36
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-2-pyridin-3-ylacetamide
CID 131931518
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
CID 7203468
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]benzamide
CID 9252709
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate
CID 139069446
methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
CID 2923381
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,3-benzodioxole-5-carboxamide
CID 992710
2-[4-(3-aminopropylamino)phenoxy]-1-morpholin-4-ylethanone
CID 117097700
2-ethyl-4-methyl-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,3-oxazole-5-carboxamide
CID 131917366
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]thiomorpholine-4-carboxamide
CID 118776743
2-(4-hydroxyphenoxy)-1-morpholin-4-ylethanone
CID 43143408
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide
CID 131932276
2-(4-methylphenoxy)-1-morpholin-4-ylethanone
CID 674914

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide (CID 131932108) is 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide is O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccncc1F.
What is the InChIKey of 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide?
The InChIKey is STPBEGGDFRGUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O4/c19-16-11-20-6-5-15(16)18(24)21-13-1-3-14(4-2-13)26-12-17(23)22-7-9-25-10-8-22/h1-6,11H,7-10,12H2,(H,21,24).
What are the key properties of 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide?
3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide has a molecular weight of 359.36 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 131932108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).