N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide

C19H20N6O3S — CID 9278448

IUPACN'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide
SMILESO=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H20N6O3S/c26-17(10-15-13-29-19(21-15)24-6-8-28-9-7-24)22-23-18(27)14-11-20-25(12-14)16-4-2-1-3-5-16/h1-5,11-13H,6-10H2,(H,22,26)(H,23,27)
InChIKeyPYVWOVPNRSNGSG-UHFFFAOYSA-N
MW412.48 g/mol
LogP1.17
Rot. Bonds5

About N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide

N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide (PubChem CID 9278448) has the molecular formula C19H20N6O3S and a molecular weight of 412.48 g/mol. Its IUPAC name is N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide
PubChem CID9278448
Molecular FormulaC19H20N6O3S
Molecular Weight412.48 g/mol
Exact Mass412.13
IUPAC NameN'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide
SMILESO=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H20N6O3S/c26-17(10-15-13-29-19(21-15)24-6-8-28-9-7-24)22-23-18(27)14-11-20-25(12-14)16-4-2-1-3-5-16/h1-5,11-13H,6-10H2,(H,22,26)(H,23,27)
InChIKeyPYVWOVPNRSNGSG-UHFFFAOYSA-N
XLogP1.17
TPSA101.38 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.48
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-morpholin-4-yl-1,3-thiazol-4-yl)-N-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]acetamide
CID 8978718
1-benzyl-3-[[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]amino]thiourea
CID 8627730
4-ethyl-N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-5-propylthiophene-2-carbohydrazide
CID 9278398
N'-(4-methylphenyl)sulfonyl-2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetohydrazide
CID 8505665
N'-[2-(2-phenyl-1,3-thiazol-4-yl)acetyl]benzohydrazide
CID 4800325
N'-[1-(4-methylphenyl)-3-phenylpyrazole-4-carbonyl]-2-morpholin-4-yl-1,3-thiazole-4-carbohydrazide
CID 46656625
2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide
CID 32810379
N-[4-(hydroxymethyl)-2-pyridinyl]-2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetamide
CID 154784296
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-1-phenylpyrazole-4-carboxamide
CID 18164203
N'-[2-(2-methylphenoxy)acetyl]-1-phenylpyrazole-4-carbohydrazide
CID 9321094
N'-(4-tert-butylbenzoyl)-1-phenylpyrazole-4-carbohydrazide
CID 9327562
N-[4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-1-phenylpyrazole-4-carboxamide
CID 30191375

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide?
The IUPAC name of N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide (CID 9278448) is N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide.
What is the SMILES notation for N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide?
The canonical SMILES for N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide is O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1cnn(-c2ccccc2)c1.
What is the InChIKey of N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide?
The InChIKey is PYVWOVPNRSNGSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O3S/c26-17(10-15-13-29-19(21-15)24-6-8-28-9-7-24)22-23-18(27)14-11-20-25(12-14)16-4-2-1-3-5-16/h1-5,11-13H,6-10H2,(H,22,26)(H,23,27).
What are the key properties of N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide?
N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide has a molecular weight of 412.48 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)acetyl]-1-phenylpyrazole-4-carbohydrazide is sourced from PubChem (CID 9278448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).