[3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine

C13H25N3OS — CID 105273836

IUPAC[3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine
SMILESCCOC(C(Cc1csc(C)n1)NN)C(C)(C)C
InChIInChI=1S/C13H25N3OS/c1-6-17-12(13(3,4)5)11(16-14)7-10-8-18-9(2)15-10/h8,11-12,16H,6-7,14H2,1-5H3
InChIKeyXNFQHMRGEDHSDK-UHFFFAOYSA-N
MW271.43 g/mol
LogP2.28
Rot. Bonds6

About [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine

[3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine (PubChem CID 105273836) has the molecular formula C13H25N3OS and a molecular weight of 271.43 g/mol. Its IUPAC name is [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine
PubChem CID105273836
Molecular FormulaC13H25N3OS
Molecular Weight271.43 g/mol
Exact Mass271.17
IUPAC Name[3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine
SMILESCCOC(C(Cc1csc(C)n1)NN)C(C)(C)C
InChIInChI=1S/C13H25N3OS/c1-6-17-12(13(3,4)5)11(16-14)7-10-8-18-9(2)15-10/h8,11-12,16H,6-7,14H2,1-5H3
InChIKeyXNFQHMRGEDHSDK-UHFFFAOYSA-N
XLogP2.28
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.43
LogP ≤ 52.28
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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Related Compounds

[3-methyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine
CID 105214739
[3,3-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine
CID 105316246
[1,1,1-trifluoro-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine
CID 105215784
[1-(2,5-dimethylpyrazol-3-yl)-3-ethoxy-4,4-dimethylpentan-2-yl]hydrazine
CID 105273802
1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine
CID 105202230
[3-ethoxy-1-(2-ethyl-1,2,4-triazol-3-yl)-4,4-dimethylpentan-2-yl]hydrazine
CID 105273812
[4-ethyl-1-(2-methyl-1,3-thiazol-4-yl)hexan-2-yl]hydrazine
CID 105214789
[1-(2-tert-butylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 105316152
[3-ethoxy-1-(2-fluorophenyl)-4,4-dimethylpentan-2-yl]hydrazine
CID 105273741
[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-methylthiophen-3-yl)ethyl]hydrazine
CID 105251888
[2-(2-methyl-1,3-thiazol-4-yl)-1-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 105253862
1-(2-methyl-1,3-thiazol-4-yl)-N,3-dipropylhexan-2-amine
CID 104996994

Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine?
The IUPAC name of [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine (CID 105273836) is [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine.
What is the SMILES notation for [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine?
The canonical SMILES for [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine is CCOC(C(Cc1csc(C)n1)NN)C(C)(C)C.
What is the InChIKey of [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine?
The InChIKey is XNFQHMRGEDHSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3OS/c1-6-17-12(13(3,4)5)11(16-14)7-10-8-18-9(2)15-10/h8,11-12,16H,6-7,14H2,1-5H3.
What are the key properties of [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine?
[3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine has a molecular weight of 271.43 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-4,4-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-2-yl]hydrazine is sourced from PubChem (CID 105273836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).