N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide

C17H19FN2OS — CID 110332925

IUPACN-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide
SMILESO=C(CCc1csc(-c2ccccc2F)n1)NC1CCCC1
InChIInChI=1S/C17H19FN2OS/c18-15-8-4-3-7-14(15)17-20-13(11-22-17)9-10-16(21)19-12-5-1-2-6-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2,(H,19,21)
InChIKeyAZMDVNIVJUXDMY-UHFFFAOYSA-N
MW318.42 g/mol
LogP3.94
Rot. Bonds5

About N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide

N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide (PubChem CID 110332925) has the molecular formula C17H19FN2OS and a molecular weight of 318.42 g/mol. Its IUPAC name is N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide
PubChem CID110332925
Molecular FormulaC17H19FN2OS
Molecular Weight318.42 g/mol
Exact Mass318.12
IUPAC NameN-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide
SMILESO=C(CCc1csc(-c2ccccc2F)n1)NC1CCCC1
InChIInChI=1S/C17H19FN2OS/c18-15-8-4-3-7-14(15)17-20-13(11-22-17)9-10-16(21)19-12-5-1-2-6-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2,(H,19,21)
InChIKeyAZMDVNIVJUXDMY-UHFFFAOYSA-N
XLogP3.94
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]propanamide
CID 110333079
N-cyclohexyl-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 9243405
N-cyclopentyl-3-[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]propanamide
CID 27453362
N-cyclohexyl-3-[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]propanamide
CID 27453366
N-cyclopentyl-3-pyridin-2-ylpropanamide
CID 78980134
3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-N-[(4-methoxyphenyl)methyl]propanamide
CID 110332946
N-cycloheptyl-3-pyridin-2-ylpropanamide
CID 110389210
N-cyclopentyl-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 26722000
N-cyclopropyl-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 17419085
N-cyclopropyl-3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 18136486
N-cyclohexyl-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 17435272
N-cyclooctyl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 17449429

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide?
The IUPAC name of N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide (CID 110332925) is N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide?
The canonical SMILES for N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide is O=C(CCc1csc(-c2ccccc2F)n1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide?
The InChIKey is AZMDVNIVJUXDMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2OS/c18-15-8-4-3-7-14(15)17-20-13(11-22-17)9-10-16(21)19-12-5-1-2-6-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2,(H,19,21).
What are the key properties of N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide?
N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide has a molecular weight of 318.42 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]propanamide is sourced from PubChem (CID 110332925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).