[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine

C13H14ClN3 — CID 106859713

IUPAC[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cccnc2)c(Cl)c1
InChIInChI=1S/C13H14ClN3/c1-9-4-5-11(12(14)7-9)13(17-15)10-3-2-6-16-8-10/h2-8,13,17H,15H2,1H3
InChIKeyOCDNUVNDSBBWQV-UHFFFAOYSA-N
MW247.73 g/mol
LogP2.60
Rot. Bonds3

About [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine

[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine (PubChem CID 106859713) has the molecular formula C13H14ClN3 and a molecular weight of 247.73 g/mol. Its IUPAC name is [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine
PubChem CID106859713
Molecular FormulaC13H14ClN3
Molecular Weight247.73 g/mol
Exact Mass247.09
IUPAC Name[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cccnc2)c(Cl)c1
InChIInChI=1S/C13H14ClN3/c1-9-4-5-11(12(14)7-9)13(17-15)10-3-2-6-16-8-10/h2-8,13,17H,15H2,1H3
InChIKeyOCDNUVNDSBBWQV-UHFFFAOYSA-N
XLogP2.60
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[(2-chloro-4-methylphenyl)-(3-methylphenyl)methyl]hydrazine
CID 106859691
[(2-fluoro-3-methylphenyl)-pyridin-3-ylmethyl]hydrazine
CID 105287127
1-(2-chloro-4-methylphenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 106857167
[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine
CID 105261077
[(5-bromo-2-fluorophenyl)-pyridin-3-ylmethyl]hydrazine
CID 105196222
[(3-ethyl-6-methylpyridazin-4-yl)-pyridin-3-ylmethyl]hydrazine
CID 105287134
[(3-chloro-4,5-dimethoxyphenyl)-pyridin-3-ylmethyl]hydrazine
CID 105204624
[(2-chloro-4-methylphenyl)-(3-methoxypyrazin-2-yl)methyl]hydrazine
CID 106860179
[(2-chloro-4-methylphenyl)-(2-ethylpyrazol-3-yl)methyl]hydrazine
CID 106859925
[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine
CID 105282916
[(2-chloro-4-methylphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 106860041
(2-bromo-4-methylphenyl)-pyridin-3-ylmethanamine
CID 115799755

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine?
The IUPAC name of [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine (CID 106859713) is [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine.
What is the SMILES notation for [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine?
The canonical SMILES for [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine is Cc1ccc(C(NN)c2cccnc2)c(Cl)c1.
What is the InChIKey of [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine?
The InChIKey is OCDNUVNDSBBWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3/c1-9-4-5-11(12(14)7-9)13(17-15)10-3-2-6-16-8-10/h2-8,13,17H,15H2,1H3.
What are the key properties of [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine?
[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine has a molecular weight of 247.73 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine is sourced from PubChem (CID 106859713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).