N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide

C12H15FN2O2S — CID 119337978

IUPACN-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1cccc(OCCF)c1)C1CSCN1
InChIInChI=1S/C12H15FN2O2S/c13-4-5-17-10-3-1-2-9(6-10)15-12(16)11-7-18-8-14-11/h1-3,6,11,14H,4-5,7-8H2,(H,15,16)
InChIKeyFSZDUMPRHMDPNZ-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.64
Rot. Bonds5

About N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide

N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 119337978) has the molecular formula C12H15FN2O2S and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide
PubChem CID119337978
Molecular FormulaC12H15FN2O2S
Molecular Weight270.33 g/mol
Exact Mass270.08
IUPAC NameN-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1cccc(OCCF)c1)C1CSCN1
InChIInChI=1S/C12H15FN2O2S/c13-4-5-17-10-3-1-2-9(6-10)15-12(16)11-7-18-8-14-11/h1-3,6,11,14H,4-5,7-8H2,(H,15,16)
InChIKeyFSZDUMPRHMDPNZ-UHFFFAOYSA-N
XLogP1.64
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(2-fluoroethoxy)phenyl]piperidine-2-carboxamide
CID 119337980
N-[3-(2-fluoroethoxy)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119808988
N-[3-(2-methoxyethoxy)phenyl]thiomorpholine-3-carboxamide
CID 82908280
N-[3-(2-fluoroethoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 126775656
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
3-[3-(1,3-thiazolidine-4-carbonylamino)phenyl]propanoic acid
CID 115339862
N-(3-ethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24703459
N-[3-(propanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61250253
N-[3-(2-fluoroethoxy)phenyl]carbamoyl chloride
CID 130015965
N-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119262127
N-[4-(2-methoxyethoxy)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43713460
N-[3-(2-fluoroethoxy)phenyl]-2,2-dimethylcyclopropane-1-carboxamide
CID 136517303

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide (CID 119337978) is N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide is O=C(Nc1cccc(OCCF)c1)C1CSCN1.
What is the InChIKey of N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is FSZDUMPRHMDPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O2S/c13-4-5-17-10-3-1-2-9(6-10)15-12(16)11-7-18-8-14-11/h1-3,6,11,14H,4-5,7-8H2,(H,15,16).
What are the key properties of N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide?
N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-fluoroethoxy)phenyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 119337978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).