4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide

C19H21FN4O3 — CID 17469565

IUPAC4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C19H21FN4O3/c20-16-4-2-15(3-5-16)19(26)23-13-18(25)22-12-14-1-6-17(21-11-14)24-7-9-27-10-8-24/h1-6,11H,7-10,12-13H2,(H,22,25)(H,23,26)
InChIKeyGVCHRQRMWRLTGM-UHFFFAOYSA-N
MW372.40 g/mol
LogP1.10
Rot. Bonds6

About 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide

4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide (PubChem CID 17469565) has the molecular formula C19H21FN4O3 and a molecular weight of 372.40 g/mol. Its IUPAC name is 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide
PubChem CID17469565
Molecular FormulaC19H21FN4O3
Molecular Weight372.40 g/mol
Exact Mass372.16
IUPAC Name4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C19H21FN4O3/c20-16-4-2-15(3-5-16)19(26)23-13-18(25)22-12-14-1-6-17(21-11-14)24-7-9-27-10-8-24/h1-6,11H,7-10,12-13H2,(H,22,25)(H,23,26)
InChIKeyGVCHRQRMWRLTGM-UHFFFAOYSA-N
XLogP1.10
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.40
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 17424871
4-(methylsulfanylmethyl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 30354650
N'-(4-fluorobenzoyl)-6-morpholin-4-ylpyridine-3-carbohydrazide
CID 46697479
2-(4-aminophenyl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide;dihydrochloride
CID 119839439
2,4-difluoro-N-[2-oxo-2-[(6-pyrrolidin-1-yl-3-pyridinyl)methylamino]ethyl]benzamide
CID 30832263
4-(2-methylpropoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 16602299
N-[[4-(difluoromethyl)phenyl]methyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 166216056
4-(4-fluorophenyl)-4-oxo-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]butanamide
CID 37483127
5-chloro-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]pentanamide
CID 43167979
4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 18204721
3,4-dimethoxy-N-[2-oxo-2-[(6-pyrrolidin-1-yl-3-pyridinyl)methylamino]ethyl]benzamide
CID 38529032
2-(3,4-difluorophenyl)sulfanyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide
CID 18145207

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide?
The IUPAC name of 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide (CID 17469565) is 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide is O=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide?
The InChIKey is GVCHRQRMWRLTGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN4O3/c20-16-4-2-15(3-5-16)19(26)23-13-18(25)22-12-14-1-6-17(21-11-14)24-7-9-27-10-8-24/h1-6,11H,7-10,12-13H2,(H,22,25)(H,23,26).
What are the key properties of 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide?
4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide has a molecular weight of 372.40 g/mol, XLogP of 1.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 17469565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).