2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide

C17H19FN4OS — CID 24889964

IUPAC2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide
SMILESCc1c2cc(F)ccc2nn1C(CC(C)C)C(=O)Nc1nccs1
InChIInChI=1S/C17H19FN4OS/c1-10(2)8-15(16(23)20-17-19-6-7-24-17)22-11(3)13-9-12(18)4-5-14(13)21-22/h4-7,9-10,15H,8H2,1-3H3,(H,19,20,23)
InChIKeyUSSOSERVDQYEOJ-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.17
Rot. Bonds5

About 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide

2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide (PubChem CID 24889964) has the molecular formula C17H19FN4OS and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide.

Molecular Properties

Compound Name2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide
PubChem CID24889964
Molecular FormulaC17H19FN4OS
Molecular Weight346.43 g/mol
Exact Mass346.13
IUPAC Name2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide
SMILESCc1c2cc(F)ccc2nn1C(CC(C)C)C(=O)Nc1nccs1
InChIInChI=1S/C17H19FN4OS/c1-10(2)8-15(16(23)20-17-19-6-7-24-17)22-11(3)13-9-12(18)4-5-14(13)21-22/h4-7,9-10,15H,8H2,1-3H3,(H,19,20,23)
InChIKeyUSSOSERVDQYEOJ-UHFFFAOYSA-N
XLogP4.17
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide?
The IUPAC name of 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide (CID 24889964) is 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide.
What is the SMILES notation for 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide?
The canonical SMILES for 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide is Cc1c2cc(F)ccc2nn1C(CC(C)C)C(=O)Nc1nccs1.
What is the InChIKey of 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide?
The InChIKey is USSOSERVDQYEOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4OS/c1-10(2)8-15(16(23)20-17-19-6-7-24-17)22-11(3)13-9-12(18)4-5-14(13)21-22/h4-7,9-10,15H,8H2,1-3H3,(H,19,20,23).
What are the key properties of 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide?
2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide has a molecular weight of 346.43 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-3-methylindazol-2-yl)-4-methyl-N-(1,3-thiazol-2-yl)pentanamide is sourced from PubChem (CID 24889964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).