N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide

C15H15FN2O2S — CID 136536388

IUPACN-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide
SMILESCC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
InChIInChI=1S/C15H15FN2O2S/c1-9-12(6-7-20-9)14(19)18-15-17-8-13(21-15)10-2-4-11(16)5-3-10/h2-5,8-9,12H,6-7H2,1H3,(H,17,18,19)
InChIKeyFYCXEMFOOXRFKP-UHFFFAOYSA-N
MW306.36 g/mol
LogP3.31
Rot. Bonds3

About N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide

N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide (PubChem CID 136536388) has the molecular formula C15H15FN2O2S and a molecular weight of 306.36 g/mol. Its IUPAC name is N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide
PubChem CID136536388
Molecular FormulaC15H15FN2O2S
Molecular Weight306.36 g/mol
Exact Mass306.08
IUPAC NameN-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide
SMILESCC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
InChIInChI=1S/C15H15FN2O2S/c1-9-12(6-7-20-9)14(19)18-15-17-8-13(21-15)10-2-4-11(16)5-3-10/h2-5,8-9,12H,6-7H2,1H3,(H,17,18,19)
InChIKeyFYCXEMFOOXRFKP-UHFFFAOYSA-N
XLogP3.31
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenyl-N-(5-propan-2-yl-2-thiazolyl)acetamide
CID 16760027
N-(5-Ethylthiazol-2-yl)-2-phenylacetamide
CID 44396065
N-(5-(4-Fluorobenzyl)-1,3-thiazol-2-YL)heptanamide
CID 1556523
N-[5-[(4-methylphenyl)methyl]-2-thiazolyl]-2-oxolanecarboxamide
CID 2888347
N-{5-[3-(trifluoromethyl)benzyl]-1,3-thiazol-2-yl}tetrahydrofuran-2-carboxamide
CID 3132752
N-(5-benzyl-1,3-thiazol-2-yl)oxolane-2-carboxamide
CID 3144220
3-cyclohexyl-N-[5-[(3-fluorophenyl)methyl]thiazol-2-yl]propanamide
CID 118726205
3-cyclohexyl-N-[5-[(2-fluorophenyl)methyl]thiazol-2-yl]propanamide
CID 118726207
2-(2-fluorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2102503
N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]oxolane-2-carboxamide
CID 3785803
N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 668748
N-(5-benzyl-1,3-thiazol-2-yl)-2-methylpropanamide
CID 1266322

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide?
The IUPAC name of N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide (CID 136536388) is N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide.
What is the SMILES notation for N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide?
The canonical SMILES for N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide is CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1.
What is the InChIKey of N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide?
The InChIKey is FYCXEMFOOXRFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2S/c1-9-12(6-7-20-9)14(19)18-15-17-8-13(21-15)10-2-4-11(16)5-3-10/h2-5,8-9,12H,6-7H2,1H3,(H,17,18,19).
What are the key properties of N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide?
N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide has a molecular weight of 306.36 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyloxolane-3-carboxamide is sourced from PubChem (CID 136536388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).