N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide

C14H17N5O2S — CID 75522350

IUPACN-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide
SMILESCn1cc(C(N)=O)c(NC(=O)c2scnc2C2CCCC2)n1
InChIInChI=1S/C14H17N5O2S/c1-19-6-9(12(15)20)13(18-19)17-14(21)11-10(16-7-22-11)8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H2,15,20)(H,17,18,21)
InChIKeyIZCPZVVAUFVZHH-UHFFFAOYSA-N
MW319.39 g/mol
LogP1.89
Rot. Bonds4

About N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide

N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide (PubChem CID 75522350) has the molecular formula C14H17N5O2S and a molecular weight of 319.39 g/mol. Its IUPAC name is N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide
PubChem CID75522350
Molecular FormulaC14H17N5O2S
Molecular Weight319.39 g/mol
Exact Mass319.11
IUPAC NameN-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide
SMILESCn1cc(C(N)=O)c(NC(=O)c2scnc2C2CCCC2)n1
InChIInChI=1S/C14H17N5O2S/c1-19-6-9(12(15)20)13(18-19)17-14(21)11-10(16-7-22-11)8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H2,15,20)(H,17,18,21)
InChIKeyIZCPZVVAUFVZHH-UHFFFAOYSA-N
XLogP1.89
TPSA102.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide (CID 75522350) is N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide is Cn1cc(C(N)=O)c(NC(=O)c2scnc2C2CCCC2)n1.
What is the InChIKey of N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide?
The InChIKey is IZCPZVVAUFVZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2S/c1-19-6-9(12(15)20)13(18-19)17-14(21)11-10(16-7-22-11)8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H2,15,20)(H,17,18,21).
What are the key properties of N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide?
N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide has a molecular weight of 319.39 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoyl-1-methylpyrazol-3-yl)-4-cyclopentyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 75522350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).