[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine

C17H27ClN2O — CID 105278524

IUPAC[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
SMILESCCOC1(C(Cc2ccc(Cl)cc2)NN)CCCCCC1
InChIInChI=1S/C17H27ClN2O/c1-2-21-17(11-5-3-4-6-12-17)16(20-19)13-14-7-9-15(18)10-8-14/h7-10,16,20H,2-6,11-13,19H2,1H3
InChIKeyUPVGQDYWAJBVBH-UHFFFAOYSA-N
MW310.87 g/mol
LogP3.84
Rot. Bonds6

About [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine

[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine (PubChem CID 105278524) has the molecular formula C17H27ClN2O and a molecular weight of 310.87 g/mol. Its IUPAC name is [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
PubChem CID105278524
Molecular FormulaC17H27ClN2O
Molecular Weight310.87 g/mol
Exact Mass310.18
IUPAC Name[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
SMILESCCOC1(C(Cc2ccc(Cl)cc2)NN)CCCCCC1
InChIInChI=1S/C17H27ClN2O/c1-2-21-17(11-5-3-4-6-12-17)16(20-19)13-14-7-9-15(18)10-8-14/h7-10,16,20H,2-6,11-13,19H2,1H3
InChIKeyUPVGQDYWAJBVBH-UHFFFAOYSA-N
XLogP3.84
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.87
LogP ≤ 53.84
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-(3-chlorophenyl)-1-(1-ethoxycyclopentyl)ethyl]hydrazine
CID 105275871
[2-(3,5-dimethylphenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276272
[2-(3,5-difluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105413025
[2-(2,6-difluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276415
[2-(2,6-dimethylphenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276343
[2-(3-chloro-2-fluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 102868215
[1-(1-ethoxycyclopentyl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105275708
[1-(1-ethoxycyclohexyl)-2-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 105276332
2-(3,4-difluorophenyl)-1-(1-ethoxycyclohexyl)-N-methylethanamine
CID 116763856
1-(1-ethoxycycloheptyl)-2-(4-fluorophenyl)-N-methylethanamine
CID 116770809
1-(1-ethoxycyclopentyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 116761943
[2-(3-chloro-4-fluorophenyl)-1-(1-methoxycyclobutyl)ethyl]hydrazine
CID 103044091

Frequently Asked Questions

What is the IUPAC name of [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
The IUPAC name of [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine (CID 105278524) is [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine is CCOC1(C(Cc2ccc(Cl)cc2)NN)CCCCCC1.
What is the InChIKey of [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
The InChIKey is UPVGQDYWAJBVBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27ClN2O/c1-2-21-17(11-5-3-4-6-12-17)16(20-19)13-14-7-9-15(18)10-8-14/h7-10,16,20H,2-6,11-13,19H2,1H3.
What are the key properties of [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine has a molecular weight of 310.87 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine is sourced from PubChem (CID 105278524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).