[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine

C13H19N3S — CID 105322125

IUPAC[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine
SMILESNNC(C1CCSC1)C1CCc2cccnc21
InChIInChI=1S/C13H19N3S/c14-16-13(10-5-7-17-8-10)11-4-3-9-2-1-6-15-12(9)11/h1-2,6,10-11,13,16H,3-5,7-8,14H2
InChIKeyZDQJAKOREZSUES-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.70
Rot. Bonds3

About [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine

[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine (PubChem CID 105322125) has the molecular formula C13H19N3S and a molecular weight of 249.38 g/mol. Its IUPAC name is [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine
PubChem CID105322125
Molecular FormulaC13H19N3S
Molecular Weight249.38 g/mol
Exact Mass249.13
IUPAC Name[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine
SMILESNNC(C1CCSC1)C1CCc2cccnc21
InChIInChI=1S/C13H19N3S/c14-16-13(10-5-7-17-8-10)11-4-3-9-2-1-6-15-12(9)11/h1-2,6,10-11,13,16H,3-5,7-8,14H2
InChIKeyZDQJAKOREZSUES-UHFFFAOYSA-N
XLogP1.70
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.70
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

[cyclooctyl(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 105255149
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
CID 105265828
[cyclobutyl(5,6,7,8-tetrahydroquinolin-8-yl)methyl]hydrazine
CID 105224521
5,6,7,8-tetrahydroquinolin-8-yl(thiolan-3-yl)methanamine
CID 105164783
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine
CID 105322035
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 79740244
N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(1,4-dithian-2-yl)methyl]ethanamine
CID 79966609
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethyl]hydrazine
CID 105265157
[7-bicyclo[4.1.0]heptanyl(5,6,7,8-tetrahydroquinolin-8-yl)methyl]hydrazine
CID 105320985
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105166161
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(pyridazin-4-yl)methyl]hydrazine
CID 105322052
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-hydrazinyl-N,N-dimethylethanamine
CID 105244815

Frequently Asked Questions

What is the IUPAC name of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine?
The IUPAC name of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine (CID 105322125) is [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine?
The canonical SMILES for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine is NNC(C1CCSC1)C1CCc2cccnc21.
What is the InChIKey of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine?
The InChIKey is ZDQJAKOREZSUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3S/c14-16-13(10-5-7-17-8-10)11-4-3-9-2-1-6-15-12(9)11/h1-2,6,10-11,13,16H,3-5,7-8,14H2.
What are the key properties of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine?
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine has a molecular weight of 249.38 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105322125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).