[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine

C16H18N4S — CID 105218619

IUPAC[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine
SMILESCc1nc(CC(NN)c2ccc3ccccc3n2)sc1C
InChIInChI=1S/C16H18N4S/c1-10-11(2)21-16(18-10)9-15(20-17)14-8-7-12-5-3-4-6-13(12)19-14/h3-8,15,20H,9,17H2,1-2H3
InChIKeyNTBCZMMBNYECTM-UHFFFAOYSA-N
MW298.42 g/mol
LogP3.06
Rot. Bonds4

About [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine

[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine (PubChem CID 105218619) has the molecular formula C16H18N4S and a molecular weight of 298.42 g/mol. Its IUPAC name is [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine
PubChem CID105218619
Molecular FormulaC16H18N4S
Molecular Weight298.42 g/mol
Exact Mass298.13
IUPAC Name[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine
SMILESCc1nc(CC(NN)c2ccc3ccccc3n2)sc1C
InChIInChI=1S/C16H18N4S/c1-10-11(2)21-16(18-10)9-15(20-17)14-8-7-12-5-3-4-6-13(12)19-14/h3-8,15,20H,9,17H2,1-2H3
InChIKeyNTBCZMMBNYECTM-UHFFFAOYSA-N
XLogP3.06
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.42
LogP ≤ 53.06
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-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinoxalin-2-ylethyl]hydrazine
CID 107357927
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-phenylethyl]hydrazine
CID 105199172
[2-(4-methylphenyl)-1-quinolin-2-ylethyl]hydrazine
CID 105218734
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
CID 105326798
[2-(2-chlorophenyl)-1-quinolin-2-ylethyl]hydrazine
CID 105218699
1-quinolin-2-ylpent-3-ynylhydrazine
CID 105218650
[1-(4-bromophenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105192292
1-quinolin-2-ylbut-3-enylhydrazine
CID 105218718
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105326726
(3-methyl-1-quinolin-2-ylhexyl)hydrazine
CID 105218682
[1-(2,5-dichlorothiophen-3-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 107970503
2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methyl-1-phenylethanamine
CID 65168981

Frequently Asked Questions

What is the IUPAC name of [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine?
The IUPAC name of [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine (CID 105218619) is [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine.
What is the SMILES notation for [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine?
The canonical SMILES for [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine is Cc1nc(CC(NN)c2ccc3ccccc3n2)sc1C.
What is the InChIKey of [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine?
The InChIKey is NTBCZMMBNYECTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4S/c1-10-11(2)21-16(18-10)9-15(20-17)14-8-7-12-5-3-4-6-13(12)19-14/h3-8,15,20H,9,17H2,1-2H3.
What are the key properties of [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine?
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine has a molecular weight of 298.42 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine is sourced from PubChem (CID 105218619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).