N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide

C19H16FN5O3 — CID 141421402

IUPACN-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
SMILESO=CNCC1CN(c2ccc(-c3[nH]ncc3-c3ccccn3)c(F)c2)C(=O)O1
InChIInChI=1S/C19H16FN5O3/c20-16-7-12(25-10-13(8-21-11-26)28-19(25)27)4-5-14(16)18-15(9-23-24-18)17-3-1-2-6-22-17/h1-7,9,11,13H,8,10H2,(H,21,26)(H,23,24)
InChIKeyCXDYVVPOVKKQFR-UHFFFAOYSA-N
MW381.37 g/mol
LogP2.35
Rot. Bonds6

About N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide

N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide (PubChem CID 141421402) has the molecular formula C19H16FN5O3 and a molecular weight of 381.37 g/mol. Its IUPAC name is N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide.

Molecular Properties

Compound NameN-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
PubChem CID141421402
Molecular FormulaC19H16FN5O3
Molecular Weight381.37 g/mol
Exact Mass381.12
IUPAC NameN-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
SMILESO=CNCC1CN(c2ccc(-c3[nH]ncc3-c3ccccn3)c(F)c2)C(=O)O1
InChIInChI=1S/C19H16FN5O3/c20-16-7-12(25-10-13(8-21-11-26)28-19(25)27)4-5-14(16)18-15(9-23-24-18)17-3-1-2-6-22-17/h1-7,9,11,13H,8,10H2,(H,21,26)(H,23,24)
InChIKeyCXDYVVPOVKKQFR-UHFFFAOYSA-N
XLogP2.35
TPSA100.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.37
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[[(5S)-3-(4-azido-3-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
CID 89363600
N-[[3-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide;hydrochloride
CID 142686777
2-amino-N-[[4-[2-fluoro-4-[(5S)-5-(formamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]phenyl]methyl]-2-pyridin-3-ylacetamide
CID 58757155
ethane;N-[[3-[3-fluoro-4-(2,2,6,6-tetrahydroxymorpholin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
CID 145494793
(5R)-3-[3-fluoro-4-(4-pyridin-2-ylpyrazol-1-yl)phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 127042021
N-[[3-[4-[2,3-difluoro-4-[(pyridin-2-ylmethylamino)methyl]phenyl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 23404268
N-[[3-[4-(2-benzyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
CID 142270595
N-[[(5S)-3-[3-fluoro-4-[6-[(2H-triazol-4-ylmethylamino)methyl]-3-pyridinyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 11430579
N-[[(5S)-3-[4-[4-(cyanomethylidene)piperidin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide
CID 24885427
N-[[(5S)-3-[3-fluoro-4-(8-formylimidazo[1,2-a]pyridin-6-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide;methane
CID 159839371
N-[[(5S)-3-[3-fluoro-4-[4-(4-pyridin-2-ylbutyl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 58045416
1-[[(5S)-3-[3-fluoro-4-(4-pyridin-2-ylpyrazol-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]pyrrolidine-2,5-dione
CID 127039701

Frequently Asked Questions

What is the IUPAC name of N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide?
The IUPAC name of N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide (CID 141421402) is N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide.
What is the SMILES notation for N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide?
The canonical SMILES for N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide is O=CNCC1CN(c2ccc(-c3[nH]ncc3-c3ccccn3)c(F)c2)C(=O)O1.
What is the InChIKey of N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide?
The InChIKey is CXDYVVPOVKKQFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O3/c20-16-7-12(25-10-13(8-21-11-26)28-19(25)27)4-5-14(16)18-15(9-23-24-18)17-3-1-2-6-22-17/h1-7,9,11,13H,8,10H2,(H,21,26)(H,23,24).
What are the key properties of N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide?
N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide has a molecular weight of 381.37 g/mol, XLogP of 2.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[3-fluoro-4-(4-pyridin-2-yl-1H-pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]formamide is sourced from PubChem (CID 141421402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).