[5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine

C12H16ClN5 — CID 62891021

IUPAC[5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine
SMILESCc1nn(Cc2nc(NN)ccc2Cl)c(C)c1C
InChIInChI=1S/C12H16ClN5/c1-7-8(2)17-18(9(7)3)6-11-10(13)4-5-12(15-11)16-14/h4-5H,6,14H2,1-3H3,(H,15,16)
InChIKeyKQCOFQJHIFMQFV-UHFFFAOYSA-N
MW265.75 g/mol
LogP2.19
Rot. Bonds3

About [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine

[5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine (PubChem CID 62891021) has the molecular formula C12H16ClN5 and a molecular weight of 265.75 g/mol. Its IUPAC name is [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine
PubChem CID62891021
Molecular FormulaC12H16ClN5
Molecular Weight265.75 g/mol
Exact Mass265.11
IUPAC Name[5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine
SMILESCc1nn(Cc2nc(NN)ccc2Cl)c(C)c1C
InChIInChI=1S/C12H16ClN5/c1-7-8(2)17-18(9(7)3)6-11-10(13)4-5-12(15-11)16-14/h4-5H,6,14H2,1-3H3,(H,15,16)
InChIKeyKQCOFQJHIFMQFV-UHFFFAOYSA-N
XLogP2.19
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.75
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine (CID 62891021) is [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine is Cc1nn(Cc2nc(NN)ccc2Cl)c(C)c1C.
What is the InChIKey of [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine?
The InChIKey is KQCOFQJHIFMQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN5/c1-7-8(2)17-18(9(7)3)6-11-10(13)4-5-12(15-11)16-14/h4-5H,6,14H2,1-3H3,(H,15,16).
What are the key properties of [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine?
[5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine has a molecular weight of 265.75 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-[(3,4,5-trimethylpyrazol-1-yl)methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 62891021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).