4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide

C11H14N4O2S — CID 43429616

IUPAC4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide
SMILESCc1csc(=O)n1CCCC(=O)Nc1cn[nH]c1
InChIInChI=1S/C11H14N4O2S/c1-8-7-18-11(17)15(8)4-2-3-10(16)14-9-5-12-13-6-9/h5-7H,2-4H2,1H3,(H,12,13)(H,14,16)
InChIKeyGKUJNCMJOOVRKU-UHFFFAOYSA-N
MW266.33 g/mol
LogP1.36
Rot. Bonds5

About 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide

4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide (PubChem CID 43429616) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide.

Molecular Properties

Compound Name4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide
PubChem CID43429616
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide
SMILESCc1csc(=O)n1CCCC(=O)Nc1cn[nH]c1
InChIInChI=1S/C11H14N4O2S/c1-8-7-18-11(17)15(8)4-2-3-10(16)14-9-5-12-13-6-9/h5-7H,2-4H2,1H3,(H,12,13)(H,14,16)
InChIKeyGKUJNCMJOOVRKU-UHFFFAOYSA-N
XLogP1.36
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1H-pyrazol-4-yl)-1-(3-sulfanylpropanoyl)pyrrolidine-3-carboxamide
CID 177681147
N-(1H-pyrazol-4-yl)-4-(3-sulfanylpropanoylamino)butanamide
CID 177681374
1-(1h-Pyrazol-4-yl)pyrrolidin-2-one
CID 134691297
(2R)-N-(1H-pyrazol-4-yl)-2-(trifluoromethylsulfanyl)propanamide
CID 38016283
(2S)-N-(1H-pyrazol-4-yl)-2-(trifluoromethylsulfanyl)propanamide
CID 38016288
N-(1H-pyrazol-4-yl)-2-(trifluoromethylsulfanyl)propanamide
CID 45816287
5-oxo-1-(1H-pyrazol-4-yl)pyrrolidine-3-sulfonyl fluoride
CID 168715868
N-(1H-pyrazol-4-yl)butanamide
CID 13450485
2-(4-oxo-1,3-thiazolidin-3-yl)-N-(1H-pyrazol-4-yl)acetamide
CID 43429369
2-acetamido-N-(1H-pyrazol-4-yl)propanamide
CID 43429400
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide
CID 43429562
2-(2-oxopyrrolidin-1-yl)-N-(1H-pyrazol-4-yl)acetamide
CID 43429572

Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide?
The IUPAC name of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide (CID 43429616) is 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide.
What is the SMILES notation for 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide?
The canonical SMILES for 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide is Cc1csc(=O)n1CCCC(=O)Nc1cn[nH]c1.
What is the InChIKey of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide?
The InChIKey is GKUJNCMJOOVRKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-8-7-18-11(17)15(8)4-2-3-10(16)14-9-5-12-13-6-9/h5-7H,2-4H2,1H3,(H,12,13)(H,14,16).
What are the key properties of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide?
4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide has a molecular weight of 266.33 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)butanamide is sourced from PubChem (CID 43429616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).