N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide

C12H10FN3OS — CID 107358656

IUPACN-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide
SMILESO=C(Nc1nc(C2CC2)cs1)c1cccnc1F
InChIInChI=1S/C12H10FN3OS/c13-10-8(2-1-5-14-10)11(17)16-12-15-9(6-18-12)7-3-4-7/h1-2,5-7H,3-4H2,(H,15,16,17)
InChIKeyGLWDYVQQWBNJFY-UHFFFAOYSA-N
MW263.30 g/mol
LogP2.81
Rot. Bonds3

About N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide

N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide (PubChem CID 107358656) has the molecular formula C12H10FN3OS and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide
PubChem CID107358656
Molecular FormulaC12H10FN3OS
Molecular Weight263.30 g/mol
Exact Mass263.05
IUPAC NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide
SMILESO=C(Nc1nc(C2CC2)cs1)c1cccnc1F
InChIInChI=1S/C12H10FN3OS/c13-10-8(2-1-5-14-10)11(17)16-12-15-9(6-18-12)7-3-4-7/h1-2,5-7H,3-4H2,(H,15,16,17)
InChIKeyGLWDYVQQWBNJFY-UHFFFAOYSA-N
XLogP2.81
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 107358521
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62174643
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385572
1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-4-carboxamide
CID 54958473
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methoxybenzamide
CID 32864791
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(trifluoromethylsulfanyl)benzamide
CID 39129852
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 32868667
2-chloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)-4,5-difluorobenzamide
CID 33301577
2-benzyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
CID 32865615
2,4-dichloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)-5-fluorobenzamide
CID 33302941
2,5-dibromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 113237268

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide?
The IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide (CID 107358656) is N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide?
The canonical SMILES for N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide is O=C(Nc1nc(C2CC2)cs1)c1cccnc1F.
What is the InChIKey of N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide?
The InChIKey is GLWDYVQQWBNJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3OS/c13-10-8(2-1-5-14-10)11(17)16-12-15-9(6-18-12)7-3-4-7/h1-2,5-7H,3-4H2,(H,15,16,17).
What are the key properties of N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide?
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-3-carboxamide is sourced from PubChem (CID 107358656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).