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

C15H16IN3 — CID 105321973

IUPAC[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine
SMILESNNC(c1cccc(I)c1)C1CCc2cccnc21
InChIInChI=1S/C15H16IN3/c16-12-5-1-3-11(9-12)15(19-17)13-7-6-10-4-2-8-18-14(10)13/h1-5,8-9,13,15,19H,6-7,17H2
InChIKeyVAOJRLIRAHVZIR-UHFFFAOYSA-N
MW365.22 g/mol
LogP2.92
Rot. Bonds3

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

[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine (PubChem CID 105321973) has the molecular formula C15H16IN3 and a molecular weight of 365.22 g/mol. Its IUPAC name is [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine
PubChem CID105321973
Molecular FormulaC15H16IN3
Molecular Weight365.22 g/mol
Exact Mass365.04
IUPAC Name[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine
SMILESNNC(c1cccc(I)c1)C1CCc2cccnc21
InChIInChI=1S/C15H16IN3/c16-12-5-1-3-11(9-12)15(19-17)13-7-6-10-4-2-8-18-14(10)13/h1-5,8-9,13,15,19H,6-7,17H2
InChIKeyVAOJRLIRAHVZIR-UHFFFAOYSA-N
XLogP2.92
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.22
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(pyridazin-4-yl)methyl]hydrazine
CID 105322052
[(3-bromo-5-chlorophenyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 107948367
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(thieno[3,2-b]pyridin-6-yl)methyl]hydrazine
CID 105256473
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,5-dimethylphenyl)methyl]hydrazine
CID 105322018
[(4-bromothiophen-2-yl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 105222545
[(2-bromo-6-fluorophenyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 105280455
N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-methylphenyl)methyl]ethanamine
CID 79748587
[(5-bromothiophen-2-yl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]hydrazine
CID 105222197
4-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(hydrazinyl)methyl]-1H-pyrazol-5-amine
CID 105231222
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105321966
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-(3-ethoxyphenyl)-N-methylmethanamine
CID 79732092
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2-methylfuran-3-yl)methyl]hydrazine
CID 105269106

Frequently Asked Questions

What is the IUPAC name of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine?
The IUPAC name of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine (CID 105321973) is [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine.
What is the SMILES notation for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine?
The canonical SMILES for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine is NNC(c1cccc(I)c1)C1CCc2cccnc21.
What is the InChIKey of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine?
The InChIKey is VAOJRLIRAHVZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16IN3/c16-12-5-1-3-11(9-12)15(19-17)13-7-6-10-4-2-8-18-14(10)13/h1-5,8-9,13,15,19H,6-7,17H2.
What are the key properties of [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine?
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine has a molecular weight of 365.22 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3-iodophenyl)methyl]hydrazine is sourced from PubChem (CID 105321973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).