[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine

C10H12ClN5 — CID 105196547

IUPAC[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine
SMILESCn1ncc(Cl)c1C(NN)c1ccncc1
InChIInChI=1S/C10H12ClN5/c1-16-10(8(11)6-14-16)9(15-12)7-2-4-13-5-3-7/h2-6,9,15H,12H2,1H3
InChIKeyXYBPAZCBONNFMD-UHFFFAOYSA-N
MW237.69 g/mol
LogP1.02
Rot. Bonds3

About [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine

[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine (PubChem CID 105196547) has the molecular formula C10H12ClN5 and a molecular weight of 237.69 g/mol. Its IUPAC name is [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine
PubChem CID105196547
Molecular FormulaC10H12ClN5
Molecular Weight237.69 g/mol
Exact Mass237.08
IUPAC Name[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine
SMILESCn1ncc(Cl)c1C(NN)c1ccncc1
InChIInChI=1S/C10H12ClN5/c1-16-10(8(11)6-14-16)9(15-12)7-2-4-13-5-3-7/h2-6,9,15H,12H2,1H3
InChIKeyXYBPAZCBONNFMD-UHFFFAOYSA-N
XLogP1.02
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.02
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 [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine?
The IUPAC name of [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine (CID 105196547) is [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine?
The canonical SMILES for [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine is Cn1ncc(Cl)c1C(NN)c1ccncc1.
What is the InChIKey of [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine?
The InChIKey is XYBPAZCBONNFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN5/c1-16-10(8(11)6-14-16)9(15-12)7-2-4-13-5-3-7/h2-6,9,15H,12H2,1H3.
What are the key properties of [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine?
[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine has a molecular weight of 237.69 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine is sourced from PubChem (CID 105196547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).