[(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine

C9H11ClN6 — CID 105203738

IUPAC[(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine
SMILESCn1ncc(Cl)c1C(NN)c1ncccn1
InChIInChI=1S/C9H11ClN6/c1-16-8(6(10)5-14-16)7(15-11)9-12-3-2-4-13-9/h2-5,7,15H,11H2,1H3
InChIKeyDOODGTIFXIVJGQ-UHFFFAOYSA-N
MW238.68 g/mol
LogP0.42
Rot. Bonds3

About [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine

[(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine (PubChem CID 105203738) has the molecular formula C9H11ClN6 and a molecular weight of 238.68 g/mol. Its IUPAC name is [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine
PubChem CID105203738
Molecular FormulaC9H11ClN6
Molecular Weight238.68 g/mol
Exact Mass238.07
IUPAC Name[(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine
SMILESCn1ncc(Cl)c1C(NN)c1ncccn1
InChIInChI=1S/C9H11ClN6/c1-16-8(6(10)5-14-16)7(15-11)9-12-3-2-4-13-9/h2-5,7,15H,11H2,1H3
InChIKeyDOODGTIFXIVJGQ-UHFFFAOYSA-N
XLogP0.42
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.68
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine
CID 105196547
[(4-chloro-1-methylpyrazol-5-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105338778
[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine
CID 105338868
[(4-chloro-1-methylpyrazol-5-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105260785
[(5-chlorofuran-2-yl)-(4-chloro-1-methylpyrazol-5-yl)methyl]hydrazine
CID 106694761
[(4-chloro-1-methylpyrazol-5-yl)-(2,5-dichlorothiophen-3-yl)methyl]hydrazine
CID 107970626
[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dibromo-2-pyridinyl)methyl]hydrazine
CID 105268450
[(4-chloro-1-methylpyrazol-5-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 105191750
[(4-chloro-1-methylpyrazol-5-yl)-(3-methylfuran-2-yl)methyl]hydrazine
CID 105269452
[(2-bromofuran-3-yl)-(4-chloro-1-methylpyrazol-5-yl)methyl]hydrazine
CID 106860241
[(4-chloro-1-methylpyrazol-5-yl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105216647
[(4-chloro-1-methylpyrazol-5-yl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
CID 105338959

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine?
The IUPAC name of [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine (CID 105203738) is [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine?
The canonical SMILES for [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine is Cn1ncc(Cl)c1C(NN)c1ncccn1.
What is the InChIKey of [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine?
The InChIKey is DOODGTIFXIVJGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN6/c1-16-8(6(10)5-14-16)7(15-11)9-12-3-2-4-13-9/h2-5,7,15H,11H2,1H3.
What are the key properties of [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine?
[(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine has a molecular weight of 238.68 g/mol, XLogP of 0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-methylpyrazol-5-yl)-pyrimidin-2-ylmethyl]hydrazine is sourced from PubChem (CID 105203738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).