2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide

C15H19N3O2S — CID 82432610

IUPAC2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide
SMILESCCCc1nc(-c2ccccc2OCC)sc1C(=O)NN
InChIInChI=1S/C15H19N3O2S/c1-3-7-11-13(14(19)18-16)21-15(17-11)10-8-5-6-9-12(10)20-4-2/h5-6,8-9H,3-4,7,16H2,1-2H3,(H,18,19)
InChIKeyHCOSPSHMFUIXRB-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.76
Rot. Bonds6

About 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide

2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide (PubChem CID 82432610) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide
PubChem CID82432610
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide
SMILESCCCc1nc(-c2ccccc2OCC)sc1C(=O)NN
InChIInChI=1S/C15H19N3O2S/c1-3-7-11-13(14(19)18-16)21-15(17-11)10-8-5-6-9-12(10)20-4-2/h5-6,8-9H,3-4,7,16H2,1-2H3,(H,18,19)
InChIKeyHCOSPSHMFUIXRB-UHFFFAOYSA-N
XLogP2.76
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[2-(2-ethoxyphenyl)-4-propyl-1,3-thiazol-5-yl]methanethiol
CID 82432604
4-propyl-2-pyridin-2-yl-1,3-thiazole-5-carbohydrazide
CID 82431708
[2-(2-ethoxyphenyl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 82432605
2-(2-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 4980399
2-(3-methoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide
CID 82432630
2-(2-methoxyphenyl)-4-methyl-1,3-thiazole-5-carbohydrazide
CID 82427033
2-(2-methoxyphenyl)-4-propyl-1,3-thiazole-5-carboximidamide
CID 82432584
ethyl 3-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]propanoate
CID 103485086
[2-(2-ethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanol
CID 82429992
(E)-3-[2-(2-ethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]prop-2-enoic acid
CID 82430008
2-[(4-methylphenoxy)methyl]-4-propyl-1,3-thiazole-5-carbohydrazide
CID 82431851
methyl 4-chloro-2-(2-propoxyphenyl)-1,3-thiazole-5-carboxylate
CID 104663044

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide?
The IUPAC name of 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide (CID 82432610) is 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide.
What is the SMILES notation for 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide?
The canonical SMILES for 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide is CCCc1nc(-c2ccccc2OCC)sc1C(=O)NN.
What is the InChIKey of 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide?
The InChIKey is HCOSPSHMFUIXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-3-7-11-13(14(19)18-16)21-15(17-11)10-8-5-6-9-12(10)20-4-2/h5-6,8-9H,3-4,7,16H2,1-2H3,(H,18,19).
What are the key properties of 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide?
2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide has a molecular weight of 305.40 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-4-propyl-1,3-thiazole-5-carbohydrazide is sourced from PubChem (CID 82432610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).