[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine

C15H28N4O — CID 105278414

IUPAC[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
SMILESCCOC1(C(NN)c2cnn(CC)c2)CCCCCC1
InChIInChI=1S/C15H28N4O/c1-3-19-12-13(11-17-19)14(18-16)15(20-4-2)9-7-5-6-8-10-15/h11-12,14,18H,3-10,16H2,1-2H3
InChIKeyLEUDUPAANHRROM-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.54
Rot. Bonds6

About [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine

[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105278414) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
PubChem CID105278414
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC Name[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
SMILESCCOC1(C(NN)c2cnn(CC)c2)CCCCCC1
InChIInChI=1S/C15H28N4O/c1-3-19-12-13(11-17-19)14(18-16)15(20-4-2)9-7-5-6-8-10-15/h11-12,14,18H,3-10,16H2,1-2H3
InChIKeyLEUDUPAANHRROM-UHFFFAOYSA-N
XLogP2.54
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-[(1-ethoxycyclopentyl)-(1-ethylpyrazol-4-yl)methyl]propan-1-amine
CID 116762353
(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol
CID 116753795
[(1-methoxycyclohexyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105275993
[(1-ethylpyrazol-4-yl)-(2-methyloxan-2-yl)methyl]hydrazine
CID 105256090
N-[(4-ethoxyoxan-4-yl)-(1-ethylpyrazol-4-yl)methyl]ethanamine
CID 116765796
N-[(1-ethoxycyclopentyl)-(1-propylpyrazol-4-yl)methyl]ethanamine
CID 116762281
[(1-methoxycyclopentyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105268662
[(4-bromo-1-ethylpyrazol-5-yl)-(1-ethoxycyclohexyl)methyl]hydrazine
CID 105276358
[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine
CID 105217294
[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine
CID 105278518
[(1-ethoxycycloheptyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105278498
[(1-ethoxycyclohexyl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105276310

Frequently Asked Questions

What is the IUPAC name of [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine (CID 105278414) is [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine is CCOC1(C(NN)c2cnn(CC)c2)CCCCCC1.
What is the InChIKey of [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is LEUDUPAANHRROM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-3-19-12-13(11-17-19)14(18-16)15(20-4-2)9-7-5-6-8-10-15/h11-12,14,18H,3-10,16H2,1-2H3.
What are the key properties of [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 280.42 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105278414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).