[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine

C15H21N3OS — CID 105214788

IUPAC[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine
SMILESCc1nc(CC(NN)c2ccc(OC(C)C)cc2)cs1
InChIInChI=1S/C15H21N3OS/c1-10(2)19-14-6-4-12(5-7-14)15(18-16)8-13-9-20-11(3)17-13/h4-7,9-10,15,18H,8,16H2,1-3H3
InChIKeyYQYNQSLWTSRYDG-UHFFFAOYSA-N
MW291.42 g/mol
LogP2.99
Rot. Bonds6

About [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine

[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine (PubChem CID 105214788) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine
PubChem CID105214788
Molecular FormulaC15H21N3OS
Molecular Weight291.42 g/mol
Exact Mass291.14
IUPAC Name[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine
SMILESCc1nc(CC(NN)c2ccc(OC(C)C)cc2)cs1
InChIInChI=1S/C15H21N3OS/c1-10(2)19-14-6-4-12(5-7-14)15(18-16)8-13-9-20-11(3)17-13/h4-7,9-10,15,18H,8,16H2,1-3H3
InChIKeyYQYNQSLWTSRYDG-UHFFFAOYSA-N
XLogP2.99
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine (CID 105214788) is [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine is Cc1nc(CC(NN)c2ccc(OC(C)C)cc2)cs1.
What is the InChIKey of [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine?
The InChIKey is YQYNQSLWTSRYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-10(2)19-14-6-4-12(5-7-14)15(18-16)8-13-9-20-11(3)17-13/h4-7,9-10,15,18H,8,16H2,1-3H3.
What are the key properties of [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine?
[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine has a molecular weight of 291.42 g/mol, XLogP of 2.99, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105214788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).