N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide

C12H15N5O3S2 — CID 124760322

IUPACN-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(S(=O)(=O)N[C@H]2CCn3nccc3C2)s1
InChIInChI=1S/C12H15N5O3S2/c1-8(18)15-12-13-7-11(21-12)22(19,20)16-9-3-5-17-10(6-9)2-4-14-17/h2,4,7,9,16H,3,5-6H2,1H3,(H,13,15,18)/t9-/m0/s1
InChIKeyLNLDQTZGDZZJNT-VIFPVBQESA-N
MW341.42 g/mol
LogP0.59
Rot. Bonds4

About N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide

N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 124760322) has the molecular formula C12H15N5O3S2 and a molecular weight of 341.42 g/mol. Its IUPAC name is N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide
PubChem CID124760322
Molecular FormulaC12H15N5O3S2
Molecular Weight341.42 g/mol
Exact Mass341.06
IUPAC NameN-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(S(=O)(=O)N[C@H]2CCn3nccc3C2)s1
InChIInChI=1S/C12H15N5O3S2/c1-8(18)15-12-13-7-11(21-12)22(19,20)16-9-3-5-17-10(6-9)2-4-14-17/h2,4,7,9,16H,3,5-6H2,1H3,(H,13,15,18)/t9-/m0/s1
InChIKeyLNLDQTZGDZZJNT-VIFPVBQESA-N
XLogP0.59
TPSA105.98 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide (CID 124760322) is N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc(S(=O)(=O)N[C@H]2CCn3nccc3C2)s1.
What is the InChIKey of N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is LNLDQTZGDZZJNT-VIFPVBQESA-N. The full InChI is InChI=1S/C12H15N5O3S2/c1-8(18)15-12-13-7-11(21-12)22(19,20)16-9-3-5-17-10(6-9)2-4-14-17/h2,4,7,9,16H,3,5-6H2,1H3,(H,13,15,18)/t9-/m0/s1.
What are the key properties of N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide?
N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 341.42 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]sulfamoyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 124760322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).