N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide

C14H16N4OS — CID 110745260

IUPACN-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1cc(-c2cccc(NC(=O)C3CSCN3)c2)n[nH]1
InChIInChI=1S/C14H16N4OS/c1-9-5-12(18-17-9)10-3-2-4-11(6-10)16-14(19)13-7-20-8-15-13/h2-6,13,15H,7-8H2,1H3,(H,16,19)(H,17,18)
InChIKeyTZUWHKOCGTXXOR-UHFFFAOYSA-N
MW288.38 g/mol
LogP1.99
Rot. Bonds3

About N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide

N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 110745260) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide
PubChem CID110745260
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC NameN-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1cc(-c2cccc(NC(=O)C3CSCN3)c2)n[nH]1
InChIInChI=1S/C14H16N4OS/c1-9-5-12(18-17-9)10-3-2-4-11(6-10)16-14(19)13-7-20-8-15-13/h2-6,13,15H,7-8H2,1H3,(H,16,19)(H,17,18)
InChIKeyTZUWHKOCGTXXOR-UHFFFAOYSA-N
XLogP1.99
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1H-pyrazol-5-yl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43711254
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
N-[3-(1H-imidazol-5-yl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 110668512
N-(3-ethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24703459
N-(3-methylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 54862152
N-[3-(propanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61250253
N-[3-(methylcarbamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61258442
N-[3-(2-methylpropanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119281758
N-[3-(propylsulfonylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 119329973
N-[3-[(dimethylamino)methyl]phenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119853195
3-[3-(1,3-thiazolidine-4-carbonylamino)phenyl]propanoic acid
CID 115339862
N-[3-(ethylcarbamoylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 119307462

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide (CID 110745260) is N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide is Cc1cc(-c2cccc(NC(=O)C3CSCN3)c2)n[nH]1.
What is the InChIKey of N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is TZUWHKOCGTXXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c1-9-5-12(18-17-9)10-3-2-4-11(6-10)16-14(19)13-7-20-8-15-13/h2-6,13,15H,7-8H2,1H3,(H,16,19)(H,17,18).
What are the key properties of N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 288.38 g/mol, XLogP of 1.99, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 110745260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).