N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide

C15H21N5OS — CID 26333543

IUPACN-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide
SMILESCC(=O)Nc1ccnn1C1CCN(Cc2cnc(C)s2)CC1
InChIInChI=1S/C15H21N5OS/c1-11(21)18-15-3-6-17-20(15)13-4-7-19(8-5-13)10-14-9-16-12(2)22-14/h3,6,9,13H,4-5,7-8,10H2,1-2H3,(H,18,21)
InChIKeyATXSRRWHDNGOTI-UHFFFAOYSA-N
MW319.43 g/mol
LogP2.44
Rot. Bonds4

About N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide

N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide (PubChem CID 26333543) has the molecular formula C15H21N5OS and a molecular weight of 319.43 g/mol. Its IUPAC name is N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide
PubChem CID26333543
Molecular FormulaC15H21N5OS
Molecular Weight319.43 g/mol
Exact Mass319.15
IUPAC NameN-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide
SMILESCC(=O)Nc1ccnn1C1CCN(Cc2cnc(C)s2)CC1
InChIInChI=1S/C15H21N5OS/c1-11(21)18-15-3-6-17-20(15)13-4-7-19(8-5-13)10-14-9-16-12(2)22-14/h3,6,9,13H,4-5,7-8,10H2,1-2H3,(H,18,21)
InChIKeyATXSRRWHDNGOTI-UHFFFAOYSA-N
XLogP2.44
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.43
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 75369831
2-(1H-pyrazol-1-yl)-N-(1-(thiazol-2-yl)piperidin-4-yl)acetamide
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(3S)-N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]oxolane-3-carboxamide
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CID 29021710
1-(2-Cyclohexylpyrazol-3-yl)-3-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]urea
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1-[3-(2-Oxopyrrolidin-1-yl)propyl]-3-[1-(1,3-thiazol-2-yl)pyrazol-3-yl]urea
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(3S)-3-pyrazol-1-yl-N-(1,3-thiazol-2-yl)butanamide
CID 92707943
N-(5-methyl-1,3-thiazol-2-yl)-2-oxo-2-[(3S)-3-pyrazol-1-ylpiperidin-1-yl]acetamide
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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide?
The IUPAC name of N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide (CID 26333543) is N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide.
What is the SMILES notation for N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide?
The canonical SMILES for N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide is CC(=O)Nc1ccnn1C1CCN(Cc2cnc(C)s2)CC1.
What is the InChIKey of N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide?
The InChIKey is ATXSRRWHDNGOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5OS/c1-11(21)18-15-3-6-17-20(15)13-4-7-19(8-5-13)10-14-9-16-12(2)22-14/h3,6,9,13H,4-5,7-8,10H2,1-2H3,(H,18,21).
What are the key properties of N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide?
N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide has a molecular weight of 319.43 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]acetamide is sourced from PubChem (CID 26333543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).