[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine

C17H21N3S — CID 105322035

IUPAC[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine
SMILESNNC(C1CCCc2sccc21)C1CCc2cccnc21
InChIInChI=1S/C17H21N3S/c18-20-17(13-4-1-5-15-12(13)8-10-21-15)14-7-6-11-3-2-9-19-16(11)14/h2-3,8-10,13-14,17,20H,1,4-7,18H2
InChIKeyUEBCEAVMKOMOSK-UHFFFAOYSA-N
MW299.44 g/mol
LogP3.12
Rot. Bonds3

About [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine

[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine (PubChem CID 105322035) has the molecular formula C17H21N3S and a molecular weight of 299.44 g/mol. Its IUPAC name is [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine
PubChem CID105322035
Molecular FormulaC17H21N3S
Molecular Weight299.44 g/mol
Exact Mass299.15
IUPAC Name[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine
SMILESNNC(C1CCCc2sccc21)C1CCc2cccnc21
InChIInChI=1S/C17H21N3S/c18-20-17(13-4-1-5-15-12(13)8-10-21-15)14-7-6-11-3-2-9-19-16(11)14/h2-3,8-10,13-14,17,20H,1,4-7,18H2
InChIKeyUEBCEAVMKOMOSK-UHFFFAOYSA-N
XLogP3.12
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 53.12
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

[cyclobutyl(5,6,7,8-tetrahydroquinolin-8-yl)methyl]hydrazine
CID 105224521
[cyclooctyl(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 105255149
[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(thiolan-3-yl)methyl]hydrazine
CID 105322125
[(1,4-dimethylpiperazin-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]hydrazine
CID 105247375
[(3,5-dimethylcyclohexyl)-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine
CID 105312196
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
CID 105265828
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thieno[3,2-b]pyridin-6-yl)methyl]hydrazine
CID 105256473
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethyl]hydrazine
CID 105265157
[2,2-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propyl]hydrazine
CID 105203138
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thiophen-2-yl)methanamine
CID 79745456
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methylcyclopentyl)methyl]hydrazine
CID 105322002

Frequently Asked Questions

What is the IUPAC name of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine?
The IUPAC name of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine (CID 105322035) is [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine.
What is the SMILES notation for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine?
The canonical SMILES for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine is NNC(C1CCCc2sccc21)C1CCc2cccnc21.
What is the InChIKey of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine?
The InChIKey is UEBCEAVMKOMOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3S/c18-20-17(13-4-1-5-15-12(13)8-10-21-15)14-7-6-11-3-2-9-19-16(11)14/h2-3,8-10,13-14,17,20H,1,4-7,18H2.
What are the key properties of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine?
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine has a molecular weight of 299.44 g/mol, XLogP of 3.12, 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(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methyl]hydrazine is sourced from PubChem (CID 105322035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).