(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone

C14H16N4OS — CID 50976368

IUPAC(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone
SMILESO=C(c1cc(C2CC2)[nH]n1)N1CCCC1c1nccs1
InChIInChI=1S/C14H16N4OS/c19-14(11-8-10(16-17-11)9-3-4-9)18-6-1-2-12(18)13-15-5-7-20-13/h5,7-9,12H,1-4,6H2,(H,16,17)
InChIKeyIHTQTKLCJOZALZ-UHFFFAOYSA-N
MW288.38 g/mol
LogP2.72
Rot. Bonds3

About (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone

(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone (PubChem CID 50976368) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone
PubChem CID50976368
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC Name(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone
SMILESO=C(c1cc(C2CC2)[nH]n1)N1CCCC1c1nccs1
InChIInChI=1S/C14H16N4OS/c19-14(11-8-10(16-17-11)9-3-4-9)18-6-1-2-12(18)13-15-5-7-20-13/h5,7-9,12H,1-4,6H2,(H,16,17)
InChIKeyIHTQTKLCJOZALZ-UHFFFAOYSA-N
XLogP2.72
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-({5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)-2-(1,3-thiazol-2-yl)piperidine
CID 45176959
2-[1-({5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)-2-pyrrolidinyl]-1,3-thiazole
CID 45188891
(5-cyclopropyl-1H-pyrazol-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 45809031
(5-cyclopropyl-1H-pyrazol-3-yl)-[4-(1,3-thiazol-2-yl)-1,4-diazepan-1-yl]methanone
CID 48428117
N-(2-(thiazol-2-yl)ethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
CID 71705685
5-cyclopropyl-N-[1-(1,3-thiazol-2-yl)cyclopentyl]-1H-pyrazole-3-carboxamide
CID 71875704
4-chloro-5-cyclopropyl-N-[1-(1,3-thiazol-2-yl)cyclopentyl]-1H-pyrazole-3-carboxamide
CID 71921524
5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
CID 71926909
(5-cyclopropyl-1H-pyrazol-3-yl)-[3-(4-ethyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 72135950
[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]-(5-propan-2-yl-1H-pyrazol-3-yl)methanone
CID 72145425
(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 72145439
5-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
CID 75373898

Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone?
The IUPAC name of (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone (CID 50976368) is (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone is O=C(c1cc(C2CC2)[nH]n1)N1CCCC1c1nccs1.
What is the InChIKey of (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone?
The InChIKey is IHTQTKLCJOZALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c19-14(11-8-10(16-17-11)9-3-4-9)18-6-1-2-12(18)13-15-5-7-20-13/h5,7-9,12H,1-4,6H2,(H,16,17).
What are the key properties of (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone?
(5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone has a molecular weight of 288.38 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 50976368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).