3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide

C11H14N4OS — CID 47298927

IUPAC3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1csc(NC(=O)CCc2cnn(C)c2)n1
InChIInChI=1S/C11H14N4OS/c1-8-7-17-11(13-8)14-10(16)4-3-9-5-12-15(2)6-9/h5-7H,3-4H2,1-2H3,(H,13,14,16)
InChIKeyRAYQEDOWQRHNMI-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.76
Rot. Bonds4

About 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide

3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 47298927) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID47298927
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1csc(NC(=O)CCc2cnn(C)c2)n1
InChIInChI=1S/C11H14N4OS/c1-8-7-17-11(13-8)14-10(16)4-3-9-5-12-15(2)6-9/h5-7H,3-4H2,1-2H3,(H,13,14,16)
InChIKeyRAYQEDOWQRHNMI-UHFFFAOYSA-N
XLogP1.76
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-[4-[[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 53612720
N-[4-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 53619910
N-[4-[[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 56825323
N-[3-(2-amino-1,3-thiazol-4-yl)propyl]-1-isopropyl-1H-pyrazole-4-carboxamide
CID 70741951
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylacetamide
CID 33303284
N-(4-tert-butyl-1,3-thiazol-2-yl)-1-methylpyrazole-4-carboxamide
CID 35524868
N-[4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-3-(1-methylpyrazol-4-yl)propanamide
CID 47061468
3-(1-methylpyrazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 47298958
1-(4-Butan-2-yl-1,3-thiazol-2-yl)-3-[1-(1-methylpyrazol-4-yl)ethyl]urea
CID 71870199
1,5-dimethyl-N-(5-propyl-1,3-thiazol-2-yl)pyrazole-4-carboxamide
CID 75445495
(3S)-N-(4-methyl-1,3-thiazol-2-yl)-3-pyrazol-1-ylbutanamide
CID 92707951
N-ethyl-N-[4-[[(2S)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 95570890

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide (CID 47298927) is 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide is Cc1csc(NC(=O)CCc2cnn(C)c2)n1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is RAYQEDOWQRHNMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-8-7-17-11(13-8)14-10(16)4-3-9-5-12-15(2)6-9/h5-7H,3-4H2,1-2H3,(H,13,14,16).
What are the key properties of 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide?
3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 250.33 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 47298927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).