[(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine

C16H24ClN3O — CID 105265723

IUPAC[(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
SMILESCOc1cc(C(NN)C2CC3CCC(C2)N3C)ccc1Cl
InChIInChI=1S/C16H24ClN3O/c1-20-12-4-5-13(20)8-11(7-12)16(19-18)10-3-6-14(17)15(9-10)21-2/h3,6,9,11-13,16,19H,4-5,7-8,18H2,1-2H3
InChIKeyAZOFCKFFEFACFB-UHFFFAOYSA-N
MW309.84 g/mol
LogP2.73
Rot. Bonds4

About [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine

[(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine (PubChem CID 105265723) has the molecular formula C16H24ClN3O and a molecular weight of 309.84 g/mol. Its IUPAC name is [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
PubChem CID105265723
Molecular FormulaC16H24ClN3O
Molecular Weight309.84 g/mol
Exact Mass309.16
IUPAC Name[(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
SMILESCOc1cc(C(NN)C2CC3CCC(C2)N3C)ccc1Cl
InChIInChI=1S/C16H24ClN3O/c1-20-12-4-5-13(20)8-11(7-12)16(19-18)10-3-6-14(17)15(9-10)21-2/h3,6,9,11-13,16,19H,4-5,7-8,18H2,1-2H3
InChIKeyAZOFCKFFEFACFB-UHFFFAOYSA-N
XLogP2.73
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine with MolForge

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Related Compounds

[(5-chloro-2-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
CID 105265902
[(4-chloro-3-methoxyphenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105320870
[(4-chloro-3-methoxyphenyl)-(2,3-dihydro-1H-inden-2-yl)methyl]hydrazine
CID 105234117
[6-bicyclo[3.1.0]hexanyl-(4-chloro-3-methoxyphenyl)methyl]hydrazine
CID 105320826
[(2-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
CID 105265688
[(2,5-dichlorophenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
CID 105265806
[(4-chloro-3-methoxyphenyl)-(2,2,3,3-tetramethylcyclopropyl)methyl]hydrazine
CID 105320846
[(3,4-dimethoxyphenyl)-(3,5-dimethylcyclohexyl)methyl]hydrazine
CID 105192235
[(4-chloro-3-methoxyphenyl)-(thian-2-yl)methyl]hydrazine
CID 105255698
(3,4-dimethoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
CID 115998021
[(4-ethylphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine
CID 105265871
[cyclopropyl-(3-methoxy-4-methylphenyl)methyl]hydrazine
CID 105314485

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine?
The IUPAC name of [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine (CID 105265723) is [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine is COc1cc(C(NN)C2CC3CCC(C2)N3C)ccc1Cl.
What is the InChIKey of [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine?
The InChIKey is AZOFCKFFEFACFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O/c1-20-12-4-5-13(20)8-11(7-12)16(19-18)10-3-6-14(17)15(9-10)21-2/h3,6,9,11-13,16,19H,4-5,7-8,18H2,1-2H3.
What are the key properties of [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine?
[(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine has a molecular weight of 309.84 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-3-methoxyphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105265723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).