[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine

C16H26N4S — CID 105313402

IUPAC[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCCc1ccsc1C(Cc1ccn(C(CC)CC)n1)NN
InChIInChI=1S/C16H26N4S/c1-4-12-8-10-21-16(12)15(18-17)11-13-7-9-20(19-13)14(5-2)6-3/h7-10,14-15,18H,4-6,11,17H2,1-3H3
InChIKeyATCSGKBTOULDFN-UHFFFAOYSA-N
MW306.48 g/mol
LogP3.62
Rot. Bonds8

About [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine

[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105313402) has the molecular formula C16H26N4S and a molecular weight of 306.48 g/mol. Its IUPAC name is [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105313402
Molecular FormulaC16H26N4S
Molecular Weight306.48 g/mol
Exact Mass306.19
IUPAC Name[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCCc1ccsc1C(Cc1ccn(C(CC)CC)n1)NN
InChIInChI=1S/C16H26N4S/c1-4-12-8-10-21-16(12)15(18-17)11-13-7-9-20(19-13)14(5-2)6-3/h7-10,14-15,18H,4-6,11,17H2,1-3H3
InChIKeyATCSGKBTOULDFN-UHFFFAOYSA-N
XLogP3.62
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.48
LogP ≤ 53.62
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

[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-chlorothiophen-2-yl)ethyl]hydrazine
CID 105312536
1-(3-chlorothiophen-2-yl)-N-methyl-2-(1-pentan-3-ylpyrazol-3-yl)ethanamine
CID 104991694
[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
CID 105312638
2-(1-butan-2-ylpyrazol-3-yl)-1-(3-ethylthiophen-2-yl)ethanamine
CID 104989680
[1-(3-ethylthiophen-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 105316099
[1-(3-ethylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105324523
[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105258715
[2-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105329598
[1-(3-ethylthiophen-2-yl)-2-(furan-3-yl)ethyl]hydrazine
CID 105331714
[1-(1-methylpyrazol-4-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105228507
[1-(3-ethylthiophen-2-yl)-2-(4-iodophenyl)ethyl]hydrazine
CID 105310241
[2-(2-bromophenyl)-1-(3-ethylthiophen-2-yl)ethyl]hydrazine
CID 105283872

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine (CID 105313402) is [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine is CCc1ccsc1C(Cc1ccn(C(CC)CC)n1)NN.
What is the InChIKey of [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is ATCSGKBTOULDFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4S/c1-4-12-8-10-21-16(12)15(18-17)11-13-7-9-20(19-13)14(5-2)6-3/h7-10,14-15,18H,4-6,11,17H2,1-3H3.
What are the key properties of [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 306.48 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105313402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).