[1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine

C16H21N3S — CID 105327477

IUPAC[1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine
SMILESNNC(CC1CCSCC1)c1cccc2cccnc12
InChIInChI=1S/C16H21N3S/c17-19-15(11-12-6-9-20-10-7-12)14-5-1-3-13-4-2-8-18-16(13)14/h1-5,8,12,15,19H,6-7,9-11,17H2
InChIKeyYHWZGDSBTQKBCE-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.27
Rot. Bonds4

About [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine

[1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine (PubChem CID 105327477) has the molecular formula C16H21N3S and a molecular weight of 287.43 g/mol. Its IUPAC name is [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine
PubChem CID105327477
Molecular FormulaC16H21N3S
Molecular Weight287.43 g/mol
Exact Mass287.15
IUPAC Name[1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine
SMILESNNC(CC1CCSCC1)c1cccc2cccnc12
InChIInChI=1S/C16H21N3S/c17-19-15(11-12-6-9-20-10-7-12)14-5-1-3-13-4-2-8-18-16(13)14/h1-5,8,12,15,19H,6-7,9-11,17H2
InChIKeyYHWZGDSBTQKBCE-UHFFFAOYSA-N
XLogP3.27
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.27
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-cyclopentyl-1-quinolin-8-ylethanol
CID 65149248
(2-cyclopropyl-1-naphthalen-1-ylethyl)hydrazine
CID 105213175
N-methyl-1-quinolin-5-yl-2-(thian-4-yl)ethanamine
CID 105171945
[2-(2-methylpropylsulfanyl)-1-quinolin-8-ylethyl]hydrazine
CID 105226697
1-quinolin-8-ylhex-4-ynylhydrazine
CID 105334997
(3-pyridin-4-yl-1-quinolin-8-ylpropyl)hydrazine
CID 105327456
[2-(5-bromothiophen-2-yl)-1-quinolin-8-ylethyl]hydrazine
CID 105295729
1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine
CID 81220023
2-(cyclopropylamino)-2-quinolin-8-ylethanol
CID 63970835
methyl 2-(cyclopropylmethylamino)-2-quinolin-8-ylacetate
CID 63969784
(3-ethylcyclopentyl)-quinolin-8-ylmethanamine
CID 81231414
2-(cycloheptylamino)-2-quinolin-8-ylethanol
CID 63970830

Frequently Asked Questions

What is the IUPAC name of [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine?
The IUPAC name of [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine (CID 105327477) is [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine is NNC(CC1CCSCC1)c1cccc2cccnc12.
What is the InChIKey of [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine?
The InChIKey is YHWZGDSBTQKBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3S/c17-19-15(11-12-6-9-20-10-7-12)14-5-1-3-13-4-2-8-18-16(13)14/h1-5,8,12,15,19H,6-7,9-11,17H2.
What are the key properties of [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine?
[1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine has a molecular weight of 287.43 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-quinolin-8-yl-2-(thian-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105327477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).