4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide

C15H10FN5OS — CID 154863965

IUPAC4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide
SMILESO=C(Nc1cn[nH]c1-c1nccs1)c1c[nH]c2cccc(F)c12
InChIInChI=1S/C15H10FN5OS/c16-9-2-1-3-10-12(9)8(6-18-10)14(22)20-11-7-19-21-13(11)15-17-4-5-23-15/h1-7,18H,(H,19,21)(H,20,22)
InChIKeyTUTZACUCNHDQQD-UHFFFAOYSA-N
MW327.34 g/mol
LogP3.41
Rot. Bonds3

About 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide

4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide (PubChem CID 154863965) has the molecular formula C15H10FN5OS and a molecular weight of 327.34 g/mol. Its IUPAC name is 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide.

Molecular Properties

Compound Name4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide
PubChem CID154863965
Molecular FormulaC15H10FN5OS
Molecular Weight327.34 g/mol
Exact Mass327.06
IUPAC Name4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide
SMILESO=C(Nc1cn[nH]c1-c1nccs1)c1c[nH]c2cccc(F)c12
InChIInChI=1S/C15H10FN5OS/c16-9-2-1-3-10-12(9)8(6-18-10)14(22)20-11-7-19-21-13(11)15-17-4-5-23-15/h1-7,18H,(H,19,21)(H,20,22)
InChIKeyTUTZACUCNHDQQD-UHFFFAOYSA-N
XLogP3.41
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 53.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 156018056
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CID 139431536
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CID 9556779
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CID 26231769
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CID 26232685
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CID 86763015

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide?
The IUPAC name of 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide (CID 154863965) is 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide.
What is the SMILES notation for 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide?
The canonical SMILES for 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide is O=C(Nc1cn[nH]c1-c1nccs1)c1c[nH]c2cccc(F)c12.
What is the InChIKey of 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide?
The InChIKey is TUTZACUCNHDQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN5OS/c16-9-2-1-3-10-12(9)8(6-18-10)14(22)20-11-7-19-21-13(11)15-17-4-5-23-15/h1-7,18H,(H,19,21)(H,20,22).
What are the key properties of 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide?
4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide has a molecular weight of 327.34 g/mol, XLogP of 3.41, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-3-carboxamide is sourced from PubChem (CID 154863965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).