[3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine

C17H23N3O — CID 62245063

IUPAC[3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine
SMILESCC1CCC(OCc2cc3ccccc3nc2NN)CC1
InChIInChI=1S/C17H23N3O/c1-12-6-8-15(9-7-12)21-11-14-10-13-4-2-3-5-16(13)19-17(14)20-18/h2-5,10,12,15H,6-9,11,18H2,1H3,(H,19,20)
InChIKeyHQOJXNUHBTXNLB-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.62
Rot. Bonds4

About [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine

[3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine (PubChem CID 62245063) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine.

Molecular Properties

Compound Name[3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine
PubChem CID62245063
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name[3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine
SMILESCC1CCC(OCc2cc3ccccc3nc2NN)CC1
InChIInChI=1S/C17H23N3O/c1-12-6-8-15(9-7-12)21-11-14-10-13-4-2-3-5-16(13)19-17(14)20-18/h2-5,10,12,15H,6-9,11,18H2,1H3,(H,19,20)
InChIKeyHQOJXNUHBTXNLB-UHFFFAOYSA-N
XLogP3.62
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.62
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'}

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Frequently Asked Questions

What is the IUPAC name of [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine?
The IUPAC name of [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine (CID 62245063) is [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine.
What is the SMILES notation for [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine?
The canonical SMILES for [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine is CC1CCC(OCc2cc3ccccc3nc2NN)CC1.
What is the InChIKey of [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine?
The InChIKey is HQOJXNUHBTXNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-12-6-8-15(9-7-12)21-11-14-10-13-4-2-3-5-16(13)19-17(14)20-18/h2-5,10,12,15H,6-9,11,18H2,1H3,(H,19,20).
What are the key properties of [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine?
[3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine has a molecular weight of 285.39 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(4-methylcyclohexyl)oxymethyl]quinolin-2-yl]hydrazine is sourced from PubChem (CID 62245063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).