(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide

C10H12N4OS — CID 35556893

IUPAC(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
SMILESCc1cnc(NC(=O)[C@@H](C)n2cccn2)s1
InChIInChI=1S/C10H12N4OS/c1-7-6-11-10(16-7)13-9(15)8(2)14-5-3-4-12-14/h3-6,8H,1-2H3,(H,11,13,15)/t8-/m1/s1
InChIKeyANBJEHSCPCTKGU-MRVPVSSYSA-N
MW236.30 g/mol
LogP1.85
Rot. Bonds3

About (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide

(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide (PubChem CID 35556893) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
PubChem CID35556893
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
SMILESCc1cnc(NC(=O)[C@@H](C)n2cccn2)s1
InChIInChI=1S/C10H12N4OS/c1-7-6-11-10(16-7)13-9(15)8(2)14-5-3-4-12-14/h3-6,8H,1-2H3,(H,11,13,15)/t8-/m1/s1
InChIKeyANBJEHSCPCTKGU-MRVPVSSYSA-N
XLogP1.85
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-pyrazol-1-yl-N-(1,3-thiazol-2-yl)propanamide
CID 35503683
N-(6-chloro-5-methyl-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 113250420
5-methyl-2-(2-pyrazol-1-ylpropanoylamino)thiophene-3-carboxylic acid
CID 55248956
N-(2,6-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 47156281
N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
CID 134060372
N-(4-hydroxy-2,5-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 106834635
N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
CID 134048750
2-pyrazol-1-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide
CID 86768177
N-phenyl-2-pyrazol-1-ylpropanamide
CID 42949018
N-(6-chloro-4-methyl-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 113262980
(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 94024935
N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide
CID 47187700

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide (CID 35556893) is (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide is Cc1cnc(NC(=O)[C@@H](C)n2cccn2)s1.
What is the InChIKey of (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
The InChIKey is ANBJEHSCPCTKGU-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-7-6-11-10(16-7)13-9(15)8(2)14-5-3-4-12-14/h3-6,8H,1-2H3,(H,11,13,15)/t8-/m1/s1.
What are the key properties of (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide has a molecular weight of 236.30 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 35556893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).