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

C16H23N5OS — CID 51104524

IUPACN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
SMILESCCc1nc(NC(=O)CN2CCC(c3ccn[nH]3)CC2)sc1C
InChIInChI=1S/C16H23N5OS/c1-3-13-11(2)23-16(18-13)19-15(22)10-21-8-5-12(6-9-21)14-4-7-17-20-14/h4,7,12H,3,5-6,8-10H2,1-2H3,(H,17,20)(H,18,19,22)
InChIKeyHEWXDKIXRLJMCP-UHFFFAOYSA-N
MW333.46 g/mol
LogP2.56
Rot. Bonds5

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

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide (PubChem CID 51104524) has the molecular formula C16H23N5OS and a molecular weight of 333.46 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
PubChem CID51104524
Molecular FormulaC16H23N5OS
Molecular Weight333.46 g/mol
Exact Mass333.16
IUPAC NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
SMILESCCc1nc(NC(=O)CN2CCC(c3ccn[nH]3)CC2)sc1C
InChIInChI=1S/C16H23N5OS/c1-3-13-11(2)23-16(18-13)19-15(22)10-21-8-5-12(6-9-21)14-4-7-17-20-14/h4,7,12H,3,5-6,8-10H2,1-2H3,(H,17,20)(H,18,19,22)
InChIKeyHEWXDKIXRLJMCP-UHFFFAOYSA-N
XLogP2.56
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.46
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-[(4-fluorophenyl)sulfonylamino]piperidin-1-yl]acetamide
CID 60508249
2-[4-[2-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60505092
N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 124749945
N-[5-[(2S)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 124749946
2-[4-(2,5-difluorobenzoyl)piperidin-1-yl]-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)acetamide
CID 55841850
2-[3-(carbamoylamino)pyrrolidin-1-yl]-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)acetamide
CID 75435699
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104392
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[4-(4-methoxyphenyl)piperidin-1-yl]acetamide
CID 16674311
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 95760394
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]acetamide
CID 112840462
N-benzyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104503
2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
CID 1437008

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide (CID 51104524) is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide is CCc1nc(NC(=O)CN2CCC(c3ccn[nH]3)CC2)sc1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
The InChIKey is HEWXDKIXRLJMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5OS/c1-3-13-11(2)23-16(18-13)19-15(22)10-21-8-5-12(6-9-21)14-4-7-17-20-14/h4,7,12H,3,5-6,8-10H2,1-2H3,(H,17,20)(H,18,19,22).
What are the key properties of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide has a molecular weight of 333.46 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 51104524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).