3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide

C15H19N3O2S — CID 63570310

IUPAC3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide
SMILESCc1csc(-c2ccc(OC(C(=O)NN)C(C)C)cc2)n1
InChIInChI=1S/C15H19N3O2S/c1-9(2)13(14(19)18-16)20-12-6-4-11(5-7-12)15-17-10(3)8-21-15/h4-9,13H,16H2,1-3H3,(H,18,19)
InChIKeyABKPQQVXEJZGBE-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.51
Rot. Bonds5

About 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide

3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide (PubChem CID 63570310) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide.

Molecular Properties

Compound Name3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide
PubChem CID63570310
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide
SMILESCc1csc(-c2ccc(OC(C(=O)NN)C(C)C)cc2)n1
InChIInChI=1S/C15H19N3O2S/c1-9(2)13(14(19)18-16)20-12-6-4-11(5-7-12)15-17-10(3)8-21-15/h4-9,13H,16H2,1-3H3,(H,18,19)
InChIKeyABKPQQVXEJZGBE-UHFFFAOYSA-N
XLogP2.51
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.51
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'}

Analyze 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butan-2-one
CID 62034527
methyl 3-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanoate
CID 43536243
2-fluoro-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]acetic acid
CID 79357223
4-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide
CID 63570309
N-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]acetamide
CID 9123257
N-[(2S)-butan-2-yl]-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]acetamide
CID 9123252
3-methyl-2-(3-methylphenoxy)butanehydrazide
CID 63575822
3-methyl-2-(4-propanoylphenoxy)butanehydrazide
CID 63576010
methyl (2S)-4-methyl-2-[[2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]acetyl]amino]pentanoate
CID 9123652
1-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butan-2-one
CID 62040002
2-[4-(2-methylpropoxy)phenyl]-1,3-thiazole-4-carbohydrazide
CID 82515992
1-methoxy-3-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]propan-2-one
CID 107508099

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide?
The IUPAC name of 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide (CID 63570310) is 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide.
What is the SMILES notation for 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide?
The canonical SMILES for 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide is Cc1csc(-c2ccc(OC(C(=O)NN)C(C)C)cc2)n1.
What is the InChIKey of 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide?
The InChIKey is ABKPQQVXEJZGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-9(2)13(14(19)18-16)20-12-6-4-11(5-7-12)15-17-10(3)8-21-15/h4-9,13H,16H2,1-3H3,(H,18,19).
What are the key properties of 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide?
3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide has a molecular weight of 305.40 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]butanehydrazide is sourced from PubChem (CID 63570310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).