1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide

C18H21FN2OS — CID 110439770

IUPAC1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
SMILESCC(C)c1csc(NC(=O)C2(c3ccccc3F)CCCC2)n1
InChIInChI=1S/C18H21FN2OS/c1-12(2)15-11-23-17(20-15)21-16(22)18(9-5-6-10-18)13-7-3-4-8-14(13)19/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,20,21,22)
InChIKeyNMRFFWITOXVFCQ-UHFFFAOYSA-N
MW332.44 g/mol
LogP4.86
Rot. Bonds4

About 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide

1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide (PubChem CID 110439770) has the molecular formula C18H21FN2OS and a molecular weight of 332.44 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
PubChem CID110439770
Molecular FormulaC18H21FN2OS
Molecular Weight332.44 g/mol
Exact Mass332.14
IUPAC Name1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
SMILESCC(C)c1csc(NC(=O)C2(c3ccccc3F)CCCC2)n1
InChIInChI=1S/C18H21FN2OS/c1-12(2)15-11-23-17(20-15)21-16(22)18(9-5-6-10-18)13-7-3-4-8-14(13)19/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,20,21,22)
InChIKeyNMRFFWITOXVFCQ-UHFFFAOYSA-N
XLogP4.86
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluorophenyl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]cyclopentane-1-carboxamide
CID 110439782
1-(4-aminophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 115913568
1-cyano-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
CID 61461950
1-(2-fluorophenyl)-N-(6-methyl-2-pyridinyl)cyclopentane-1-carboxamide
CID 110439778
2-amino-3-fluoro-N-(4-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 62661911
1-(2-fluorophenyl)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
CID 100672872
4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)oxane-4-carboxamide
CID 113280718
N-(4-propan-2-yl-1,3-thiazol-2-yl)-3-propylpyrrolidine-3-carboxamide
CID 63142538
N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]-1-(2-fluorophenyl)cyclopentane-1-carboxamide
CID 2353835
1-benzyl-3-(4-propan-2-yl-1,3-thiazol-2-yl)urea
CID 103616001
N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-propylpiperidine-4-carboxamide
CID 63129103
N-(6-ethoxy-2-methyl-3-pyridinyl)-1-(2-fluorophenyl)cyclopentane-1-carboxamide
CID 100769710

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide (CID 110439770) is 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide is CC(C)c1csc(NC(=O)C2(c3ccccc3F)CCCC2)n1.
What is the InChIKey of 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The InChIKey is NMRFFWITOXVFCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2OS/c1-12(2)15-11-23-17(20-15)21-16(22)18(9-5-6-10-18)13-7-3-4-8-14(13)19/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,20,21,22).
What are the key properties of 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide has a molecular weight of 332.44 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 110439770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).