N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide

C7H7FN2O2S — CID 175957268

IUPACN-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide
SMILESO=C(Nc1ncc(F)s1)C1COC1
InChIInChI=1S/C7H7FN2O2S/c8-5-1-9-7(13-5)10-6(11)4-2-12-3-4/h1,4H,2-3H2,(H,9,10,11)
InChIKeyPUGGDHJHRVJOHY-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.87
Rot. Bonds2

About N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide

N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide (PubChem CID 175957268) has the molecular formula C7H7FN2O2S and a molecular weight of 202.21 g/mol. Its IUPAC name is N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide
PubChem CID175957268
Molecular FormulaC7H7FN2O2S
Molecular Weight202.21 g/mol
Exact Mass202.02
IUPAC NameN-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide
SMILESO=C(Nc1ncc(F)s1)C1COC1
InChIInChI=1S/C7H7FN2O2S/c8-5-1-9-7(13-5)10-6(11)4-2-12-3-4/h1,4H,2-3H2,(H,9,10,11)
InChIKeyPUGGDHJHRVJOHY-UHFFFAOYSA-N
XLogP0.87
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,4S)-N-(5-fluoro-1,3-thiazol-2-yl)-4-hydroxypyrrolidine-2-carboxamide
CID 59436460
(2S)-N-(5-fluoro-1,3-thiazol-2-yl)-2-methyl-3-(oxan-4-yl)propanamide
CID 143895910
N-[4-[C-[(5-fluoro-1,3-thiazol-2-yl)carbamoyl]-N-[(3R)-oxolan-3-yl]oxycarbonimidoyl]phenyl]cyclopropanecarboxamide
CID 90867288
3-cyclopentyl-N-(5-fluoro-1,3-thiazol-2-yl)propanamide
CID 87418060
N-(5-methyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 3432578
(E)-3-[2-(oxolane-3-carbonylamino)-1,3-thiazol-5-yl]prop-2-enoic acid
CID 109374924
N-(5-ethynyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 144888956
N-[5-(4-hydroxybut-1-ynyl)-1,3-thiazol-2-yl]oxolane-3-carboxamide
CID 61277085
2-(4-cyclopropylsulfanylphenyl)-N-(5-fluoro-1,3-thiazol-2-yl)acetamide
CID 143392302
N-(5-bromo-1,3-thiazol-2-yl)cyclooctanecarboxamide
CID 65018719
N-(5-ethyl-1,3-thiazol-2-yl)azetidine-3-carboxamide;hydrochloride
CID 130678944
(3S)-4-(2,2-difluoroethyl)-N-(5-ethyl-1,3-thiazol-2-yl)morpholine-3-carboxamide
CID 99785914

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide?
The IUPAC name of N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide (CID 175957268) is N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide.
What is the SMILES notation for N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide?
The canonical SMILES for N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide is O=C(Nc1ncc(F)s1)C1COC1.
What is the InChIKey of N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide?
The InChIKey is PUGGDHJHRVJOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2O2S/c8-5-1-9-7(13-5)10-6(11)4-2-12-3-4/h1,4H,2-3H2,(H,9,10,11).
What are the key properties of N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide?
N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide has a molecular weight of 202.21 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-1,3-thiazol-2-yl)oxetane-3-carboxamide is sourced from PubChem (CID 175957268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).