[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine

C12H23N3OS — CID 105275180

IUPAC[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine
SMILESCCOC(CC)(CC)C(Cc1nccs1)NN
InChIInChI=1S/C12H23N3OS/c1-4-12(5-2,16-6-3)10(15-13)9-11-14-7-8-17-11/h7-8,10,15H,4-6,9,13H2,1-3H3
InChIKeyNPKSOSDHYVZHNT-UHFFFAOYSA-N
MW257.40 g/mol
LogP2.11
Rot. Bonds8

About [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine

[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine (PubChem CID 105275180) has the molecular formula C12H23N3OS and a molecular weight of 257.40 g/mol. Its IUPAC name is [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine
PubChem CID105275180
Molecular FormulaC12H23N3OS
Molecular Weight257.40 g/mol
Exact Mass257.16
IUPAC Name[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine
SMILESCCOC(CC)(CC)C(Cc1nccs1)NN
InChIInChI=1S/C12H23N3OS/c1-4-12(5-2,16-6-3)10(15-13)9-11-14-7-8-17-11/h7-8,10,15H,4-6,9,13H2,1-3H3
InChIKeyNPKSOSDHYVZHNT-UHFFFAOYSA-N
XLogP2.11
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.40
LogP ≤ 52.11
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

[3,3-dimethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine
CID 105324712
N,N-diethyl-2-hydrazinyl-3-methyl-1-(1,3-thiazol-2-yl)pentan-3-amine
CID 105240949
[1-(3-bromothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
CID 105275170
[3-methyl-3-pyrrolidin-1-yl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine
CID 105241191
3-methoxy-3-methyl-1-(1,3-thiazol-2-yl)pentan-2-amine
CID 116757294
[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
CID 105275195
[3-methyl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
CID 105199664
[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
CID 105240194
3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-amine
CID 105015255
2-N,3-N,3-N,3-tetraethyl-1-(1,3-thiazol-2-yl)pentane-2,3-diamine
CID 79825166
[3-ethoxy-1-(1,3-thiazol-2-yl)hexan-2-yl]hydrazine
CID 105271499
[4-propoxy-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
CID 105324590

Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine?
The IUPAC name of [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine (CID 105275180) is [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine.
What is the SMILES notation for [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine?
The canonical SMILES for [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine is CCOC(CC)(CC)C(Cc1nccs1)NN.
What is the InChIKey of [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine?
The InChIKey is NPKSOSDHYVZHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3OS/c1-4-12(5-2,16-6-3)10(15-13)9-11-14-7-8-17-11/h7-8,10,15H,4-6,9,13H2,1-3H3.
What are the key properties of [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine?
[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine has a molecular weight of 257.40 g/mol, XLogP of 2.11, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine is sourced from PubChem (CID 105275180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).