CID 59369598

C8H7F2NOS — CID 59369598

IUPAC—
SMILES[CH]c1csc(C(=O)NCC(F)F)c1
InChIInChI=1S/C8H7F2NOS/c1-5-2-6(13-4-5)8(12)11-3-7(9)10/h1-2,4,7H,3H2,(H,11,12)
InChIKeyOWDYGKWOQGTRKW-UHFFFAOYSA-N
MW203.21 g/mol
LogP1.80
Rot. Bonds3

About CID 59369598

CID 59369598 (PubChem CID 59369598) has the molecular formula C8H7F2NOS and a molecular weight of 203.21 g/mol.

Molecular Properties

Compound NameCID 59369598
PubChem CID59369598
Molecular FormulaC8H7F2NOS
Molecular Weight203.21 g/mol
Exact Mass203.02
IUPAC Name—
SMILES[CH]c1csc(C(=O)NCC(F)F)c1
InChIInChI=1S/C8H7F2NOS/c1-5-2-6(13-4-5)8(12)11-3-7(9)10/h1-2,4,7H,3H2,(H,11,12)
InChIKeyOWDYGKWOQGTRKW-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexylthiophene-2-carboxamide
CID 855035
Thiophene derivative, 3b
CID 25023796
Acetamide, N-(3-trifluoromethylbenzyl)-2-(2-thienyl)-
CID 566340
N-(2-ethylhexyl)-2-thiophenecarboxamide
CID 2915198
N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide
CID 2255653
N-(2-Phenylethyl)-2-thiophenecarboxamide
CID 728650
4-methyl-N-[2-(2-thienyl)ethyl]benzamide
CID 1511023
6H,7H-thieno[2,3-c]pyridin-7-one
CID 4983386
N-(cyclohexylmethyl)-4-(2,2,2-trifluoroacetyl)thiophene-2-carboxamide
CID 25023817
N-[2-(4-fluorophenyl)ethyl]-5-methyl-2-thiophenecarboxamide
CID 1247475
N-[(2-fluorophenyl)methyl]-2-thiophen-3-ylacetamide
CID 8013080
3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide
CID 25162656

Frequently Asked Questions

What is the IUPAC name of CID 59369598?
The IUPAC name of CID 59369598 (CID 59369598) is not available.
What is the SMILES notation for CID 59369598?
The canonical SMILES for CID 59369598 is [CH]c1csc(C(=O)NCC(F)F)c1.
What is the InChIKey of CID 59369598?
The InChIKey is OWDYGKWOQGTRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2NOS/c1-5-2-6(13-4-5)8(12)11-3-7(9)10/h1-2,4,7H,3H2,(H,11,12).
What are the key properties of CID 59369598?
CID 59369598 has a molecular weight of 203.21 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59369598 is sourced from PubChem (CID 59369598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).