(2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine

C13H17N3S — CID 105225457

IUPAC(2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine
SMILESCCSCC(NN)c1cccc2ncccc12
InChIInChI=1S/C13H17N3S/c1-2-17-9-13(16-14)11-5-3-7-12-10(11)6-4-8-15-12/h3-8,13,16H,2,9,14H2,1H3
InChIKeyUUAJCKXDRPJOEC-UHFFFAOYSA-N
MW247.37 g/mol
LogP2.49
Rot. Bonds5

About (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine

(2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine (PubChem CID 105225457) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine.

Molecular Properties

Compound Name(2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine
PubChem CID105225457
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC Name(2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine
SMILESCCSCC(NN)c1cccc2ncccc12
InChIInChI=1S/C13H17N3S/c1-2-17-9-13(16-14)11-5-3-7-12-10(11)6-4-8-15-12/h3-8,13,16H,2,9,14H2,1H3
InChIKeyUUAJCKXDRPJOEC-UHFFFAOYSA-N
XLogP2.49
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-ethylsulfanyl-N-methyl-1-quinolin-5-ylethanamine
CID 81232043
(2-tert-butylsulfanyl-1-quinolin-5-ylethyl)hydrazine
CID 105226551
1-quinolin-5-ylpentylhydrazine
CID 105245773
1-quinolin-5-ylpent-3-ynylhydrazine
CID 105290528
(3-methoxy-3-methyl-1-quinolin-5-ylbutyl)hydrazine
CID 103025431
(4-ethylsulfonyl-1-quinolin-5-ylbutyl)hydrazine
CID 105310780
(2-phenoxy-1-quinolin-5-ylethyl)hydrazine
CID 105213090
[(3-ethyl-2-pyridinyl)-quinolin-5-ylmethyl]hydrazine
CID 105263880
[2-(4-fluorophenyl)-1-quinolin-5-ylethyl]hydrazine
CID 105198380
[2-(4-bromophenyl)-1-quinolin-5-ylethyl]hydrazine
CID 105195623
[2-(5-bromo-2-pyridinyl)-1-quinolin-5-ylethyl]hydrazine
CID 105334462
[1-(2-chlorophenyl)-2-ethylsulfanylethyl]hydrazine
CID 105225206

Frequently Asked Questions

What is the IUPAC name of (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine?
The IUPAC name of (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine (CID 105225457) is (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine.
What is the SMILES notation for (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine?
The canonical SMILES for (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine is CCSCC(NN)c1cccc2ncccc12.
What is the InChIKey of (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine?
The InChIKey is UUAJCKXDRPJOEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-2-17-9-13(16-14)11-5-3-7-12-10(11)6-4-8-15-12/h3-8,13,16H,2,9,14H2,1H3.
What are the key properties of (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine?
(2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine has a molecular weight of 247.37 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylsulfanyl-1-quinolin-5-ylethyl)hydrazine is sourced from PubChem (CID 105225457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).