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

C16H18ClN3 — CID 105341397

IUPAC[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1ccncc1Cl)c1ccccc1C1CCC1
InChIInChI=1S/C16H18ClN3/c17-15-10-19-9-8-14(15)16(20-18)13-7-2-1-6-12(13)11-4-3-5-11/h1-2,6-11,16,20H,3-5,18H2
InChIKeyPWJCEAAGMDJTHH-UHFFFAOYSA-N
MW287.79 g/mol
LogP3.56
Rot. Bonds4

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

[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine (PubChem CID 105341397) has the molecular formula C16H18ClN3 and a molecular weight of 287.79 g/mol. Its IUPAC name is [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
PubChem CID105341397
Molecular FormulaC16H18ClN3
Molecular Weight287.79 g/mol
Exact Mass287.12
IUPAC Name[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1ccncc1Cl)c1ccccc1C1CCC1
InChIInChI=1S/C16H18ClN3/c17-15-10-19-9-8-14(15)16(20-18)13-7-2-1-6-12(13)11-4-3-5-11/h1-2,6-11,16,20H,3-5,18H2
InChIKeyPWJCEAAGMDJTHH-UHFFFAOYSA-N
XLogP3.56
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.79
LogP ≤ 53.56
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-chlorophenyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 105211009
[(3-chloro-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 103445654
[(2-cyclobutylphenyl)-(2,5-dichlorophenyl)methyl]hydrazine
CID 105341360
[(3-chloro-4-pyridinyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105285750
[(2-cyclobutylphenyl)-(2-iodophenyl)methyl]hydrazine
CID 105341369
[(3-chloro-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105304839
1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine
CID 114604437
[(2-cyclobutylphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105341425
1-(2-cyclobutylphenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105066142
[(2-cyclobutylphenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 105341367
[(2-cyclobutylphenyl)-(2,3-difluorophenyl)methyl]hydrazine
CID 105341400
1-(2-cyclobutylphenyl)ethylhydrazine
CID 105201232

Frequently Asked Questions

What is the IUPAC name of [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine (CID 105341397) is [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine is NNC(c1ccncc1Cl)c1ccccc1C1CCC1.
What is the InChIKey of [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
The InChIKey is PWJCEAAGMDJTHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3/c17-15-10-19-9-8-14(15)16(20-18)13-7-2-1-6-12(13)11-4-3-5-11/h1-2,6-11,16,20H,3-5,18H2.
What are the key properties of [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine has a molecular weight of 287.79 g/mol, XLogP of 3.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine is sourced from PubChem (CID 105341397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).