[(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine

C14H16ClN3 — CID 103445949

IUPAC[(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine
SMILESCCc1ccc(C(NN)c2ncccc2Cl)cc1
InChIInChI=1S/C14H16ClN3/c1-2-10-5-7-11(8-6-10)13(18-16)14-12(15)4-3-9-17-14/h3-9,13,18H,2,16H2,1H3
InChIKeyMMHSSJUFTMPIMO-UHFFFAOYSA-N
MW261.76 g/mol
LogP2.85
Rot. Bonds4

About [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine

[(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine (PubChem CID 103445949) has the molecular formula C14H16ClN3 and a molecular weight of 261.76 g/mol. Its IUPAC name is [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine
PubChem CID103445949
Molecular FormulaC14H16ClN3
Molecular Weight261.76 g/mol
Exact Mass261.10
IUPAC Name[(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine
SMILESCCc1ccc(C(NN)c2ncccc2Cl)cc1
InChIInChI=1S/C14H16ClN3/c1-2-10-5-7-11(8-6-10)13(18-16)14-12(15)4-3-9-17-14/h3-9,13,18H,2,16H2,1H3
InChIKeyMMHSSJUFTMPIMO-UHFFFAOYSA-N
XLogP2.85
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.76
LogP ≤ 52.85
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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Frequently Asked Questions

What is the IUPAC name of [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine (CID 103445949) is [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine is CCc1ccc(C(NN)c2ncccc2Cl)cc1.
What is the InChIKey of [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine?
The InChIKey is MMHSSJUFTMPIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3/c1-2-10-5-7-11(8-6-10)13(18-16)14-12(15)4-3-9-17-14/h3-9,13,18H,2,16H2,1H3.
What are the key properties of [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine?
[(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine has a molecular weight of 261.76 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine is sourced from PubChem (CID 103445949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).