[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine

C17H22N2OS — CID 105303655

IUPAC[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccc(C(NN)c2cc3c(s2)CCC3)cc1
InChIInChI=1S/C17H22N2OS/c1-2-10-20-14-8-6-12(7-9-14)17(19-18)16-11-13-4-3-5-15(13)21-16/h6-9,11,17,19H,2-5,10,18H2,1H3
InChIKeyFYDQPKGSAGXGPY-UHFFFAOYSA-N
MW302.44 g/mol
LogP3.58
Rot. Bonds6

About [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine

[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine (PubChem CID 105303655) has the molecular formula C17H22N2OS and a molecular weight of 302.44 g/mol. Its IUPAC name is [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine
PubChem CID105303655
Molecular FormulaC17H22N2OS
Molecular Weight302.44 g/mol
Exact Mass302.15
IUPAC Name[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccc(C(NN)c2cc3c(s2)CCC3)cc1
InChIInChI=1S/C17H22N2OS/c1-2-10-20-14-8-6-12(7-9-14)17(19-18)16-11-13-4-3-5-15(13)21-16/h6-9,11,17,19H,2-5,10,18H2,1H3
InChIKeyFYDQPKGSAGXGPY-UHFFFAOYSA-N
XLogP3.58
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 53.58
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

[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-ethylphenyl)methyl]hydrazine
CID 105326278
[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303654
[(3-chloro-4-methylphenyl)-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]hydrazine
CID 107562528
N-[(4-chlorophenyl)-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)methyl]propan-1-amine
CID 43494735
2-[chloro-(4-ethoxyphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene
CID 63428614
[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330505
N-[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(2,3-dihydro-1H-inden-5-yl)methyl]ethanamine
CID 43491715
2-[bromo-(4-ethoxyphenyl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene
CID 63436925
5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methanone
CID 114971100
N-[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(6-methyl-3-pyridinyl)methyl]propan-1-amine
CID 115854665
[(4,5-dimethylthiophen-2-yl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105300674
1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)undecylhydrazine
CID 105298347

Frequently Asked Questions

What is the IUPAC name of [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine?
The IUPAC name of [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine (CID 105303655) is [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine?
The canonical SMILES for [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine is CCCOc1ccc(C(NN)c2cc3c(s2)CCC3)cc1.
What is the InChIKey of [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine?
The InChIKey is FYDQPKGSAGXGPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2OS/c1-2-10-20-14-8-6-12(7-9-14)17(19-18)16-11-13-4-3-5-15(13)21-16/h6-9,11,17,19H,2-5,10,18H2,1H3.
What are the key properties of [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine?
[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine has a molecular weight of 302.44 g/mol, XLogP of 3.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105303655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).