5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide

C19H19N5O2S — CID 78153904

IUPAC5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide
SMILESCOc1ccccc1C1CC(C(=O)Nc2nc(-c3ccncc3)cs2)NN1
InChIInChI=1S/C19H19N5O2S/c1-26-17-5-3-2-4-13(17)14-10-15(24-23-14)18(25)22-19-21-16(11-27-19)12-6-8-20-9-7-12/h2-9,11,14-15,23-24H,10H2,1H3,(H,21,22,25)
InChIKeyURWYKQNPHAKIRL-UHFFFAOYSA-N
MW381.46 g/mol
LogP2.76
Rot. Bonds5

About 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide

5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide (PubChem CID 78153904) has the molecular formula C19H19N5O2S and a molecular weight of 381.46 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide
PubChem CID78153904
Molecular FormulaC19H19N5O2S
Molecular Weight381.46 g/mol
Exact Mass381.13
IUPAC Name5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide
SMILESCOc1ccccc1C1CC(C(=O)Nc2nc(-c3ccncc3)cs2)NN1
InChIInChI=1S/C19H19N5O2S/c1-26-17-5-3-2-4-13(17)14-10-15(24-23-14)18(25)22-19-21-16(11-27-19)12-6-8-20-9-7-12/h2-9,11,14-15,23-24H,10H2,1H3,(H,21,22,25)
InChIKeyURWYKQNPHAKIRL-UHFFFAOYSA-N
XLogP2.76
TPSA88.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

2,3-dimethoxy-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide
CID 22581346
N-(3,4-dimethoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975396
N-(4-methoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975398
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 868787
N-(3-chloro-4-methoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975433
(2R,4R)-N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-hydroxypyrrolidine-2-carboxamide
CID 125134682
5-(2-methoxyphenyl)-N-(4-oxo-3-propan-2-ylquinazolin-6-yl)pyrazolidine-3-carboxamide
CID 134086369
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide
CID 2114533
phenyl N-(4-pyridin-4-yl-1,3-thiazol-2-yl)carbamate
CID 87406304
2-phenoxy-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide
CID 9111057
N-(5-chloro-2,4-dimethoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975401
N-[5-(2-methoxyphenyl)pyrazolidin-3-yl]pyridine-2-carboxamide
CID 75613914

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide?
The IUPAC name of 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide (CID 78153904) is 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide?
The canonical SMILES for 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide is COc1ccccc1C1CC(C(=O)Nc2nc(-c3ccncc3)cs2)NN1.
What is the InChIKey of 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide?
The InChIKey is URWYKQNPHAKIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2S/c1-26-17-5-3-2-4-13(17)14-10-15(24-23-14)18(25)22-19-21-16(11-27-19)12-6-8-20-9-7-12/h2-9,11,14-15,23-24H,10H2,1H3,(H,21,22,25).
What are the key properties of 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide?
5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide has a molecular weight of 381.46 g/mol, XLogP of 2.76, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 78153904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).