[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine

C16H21N3S — CID 105322071

IUPAC[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine
SMILESNNC(CCCc1cccs1)C1CCc2cccnc21
InChIInChI=1S/C16H21N3S/c17-19-15(7-1-5-13-6-3-11-20-13)14-9-8-12-4-2-10-18-16(12)14/h2-4,6,10-11,14-15,19H,1,5,7-9,17H2
InChIKeyKBWRKFLWMYXXEZ-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.03
Rot. Bonds6

About [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine

[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine (PubChem CID 105322071) has the molecular formula C16H21N3S and a molecular weight of 287.43 g/mol. Its IUPAC name is [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine
PubChem CID105322071
Molecular FormulaC16H21N3S
Molecular Weight287.43 g/mol
Exact Mass287.15
IUPAC Name[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine
SMILESNNC(CCCc1cccs1)C1CCc2cccnc21
InChIInChI=1S/C16H21N3S/c17-19-15(7-1-5-13-6-3-11-20-13)14-9-8-12-4-2-10-18-16(12)14/h2-4,6,10-11,14-15,19H,1,5,7-9,17H2
InChIKeyKBWRKFLWMYXXEZ-UHFFFAOYSA-N
XLogP3.03
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.03
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-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-hydrazinyl-N,N-dimethylethanamine
CID 105244815
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylpentyl]hydrazine
CID 105322059
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutan-1-one
CID 105115445
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiophen-2-yl)methanamine
CID 79745456
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105198346
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine
CID 79747782
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(pyridazin-4-yl)methyl]hydrazine
CID 105322052
1-(5,6,7,8-tetrahydroquinolin-8-yl)-4-thiophen-2-ylbutan-1-one
CID 105114181
[(4-bromothiophen-2-yl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 105222545
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethyl]hydrazine
CID 105265157
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butan-1-amine
CID 79748418
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiolan-3-yl)methyl]hydrazine
CID 105322125

Frequently Asked Questions

What is the IUPAC name of [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine?
The IUPAC name of [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine (CID 105322071) is [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine.
What is the SMILES notation for [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine?
The canonical SMILES for [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine is NNC(CCCc1cccs1)C1CCc2cccnc21.
What is the InChIKey of [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine?
The InChIKey is KBWRKFLWMYXXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3S/c17-19-15(7-1-5-13-6-3-11-20-13)14-9-8-12-4-2-10-18-16(12)14/h2-4,6,10-11,14-15,19H,1,5,7-9,17H2.
What are the key properties of [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine?
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine has a molecular weight of 287.43 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-thiophen-2-ylbutyl]hydrazine is sourced from PubChem (CID 105322071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).