[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine

C12H18ClN3O — CID 66322056

IUPAC[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(Cl)c(COCC2CCCC2)n1
InChIInChI=1S/C12H18ClN3O/c13-10-5-6-12(16-14)15-11(10)8-17-7-9-3-1-2-4-9/h5-6,9H,1-4,7-8,14H2,(H,15,16)
InChIKeySWXGRCBHAIXVMS-UHFFFAOYSA-N
MW255.75 g/mol
LogP2.73
Rot. Bonds5

About [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine

[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine (PubChem CID 66322056) has the molecular formula C12H18ClN3O and a molecular weight of 255.75 g/mol. Its IUPAC name is [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine
PubChem CID66322056
Molecular FormulaC12H18ClN3O
Molecular Weight255.75 g/mol
Exact Mass255.11
IUPAC Name[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(Cl)c(COCC2CCCC2)n1
InChIInChI=1S/C12H18ClN3O/c13-10-5-6-12(16-14)15-11(10)8-17-7-9-3-1-2-4-9/h5-6,9H,1-4,7-8,14H2,(H,15,16)
InChIKeySWXGRCBHAIXVMS-UHFFFAOYSA-N
XLogP2.73
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.75
LogP ≤ 52.73
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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Frequently Asked Questions

What is the IUPAC name of [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine?
The IUPAC name of [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine (CID 66322056) is [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine is NNc1ccc(Cl)c(COCC2CCCC2)n1.
What is the InChIKey of [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine?
The InChIKey is SWXGRCBHAIXVMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3O/c13-10-5-6-12(16-14)15-11(10)8-17-7-9-3-1-2-4-9/h5-6,9H,1-4,7-8,14H2,(H,15,16).
What are the key properties of [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine?
[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine has a molecular weight of 255.75 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 66322056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).