[3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine

C13H17N3O2 — CID 62245819

IUPAC[3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine
SMILESCCOCc1cc2ccc(OC)cc2nc1NN
InChIInChI=1S/C13H17N3O2/c1-3-18-8-10-6-9-4-5-11(17-2)7-12(9)15-13(10)16-14/h4-7H,3,8,14H2,1-2H3,(H,15,16)
InChIKeyNKDUYQYEGWPVRD-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.07
Rot. Bonds5

About [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine

[3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine (PubChem CID 62245819) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine
PubChem CID62245819
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name[3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine
SMILESCCOCc1cc2ccc(OC)cc2nc1NN
InChIInChI=1S/C13H17N3O2/c1-3-18-8-10-6-9-4-5-11(17-2)7-12(9)15-13(10)16-14/h4-7H,3,8,14H2,1-2H3,(H,15,16)
InChIKeyNKDUYQYEGWPVRD-UHFFFAOYSA-N
XLogP2.07
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.07
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-ethyl-N-[(2-hydrazinyl-7-methoxyquinolin-3-yl)methyl]ethanamine
CID 62244421
[7-methoxy-3-(methylsulfanylmethyl)quinolin-2-yl]hydrazine
CID 62251762
methyl 2-[(2-hydrazinyl-7-methoxyquinolin-3-yl)methylsulfanyl]acetate
CID 62251194
7-methoxy-3-(methoxymethyl)-N-propylquinolin-2-amine
CID 62194206
3-(butoxymethyl)-7-methoxyquinolin-2-amine
CID 55044888
7-methoxy-N-methyl-3-[(2-methylpropan-2-yl)oxymethyl]quinolin-2-amine
CID 62193406
3-(butan-2-yloxymethyl)-7-methoxy-N-methylquinolin-2-amine
CID 62188180
7-methoxy-3-(propan-2-yloxymethyl)-N-propylquinolin-2-amine
CID 62193913
2-chloro-7-methoxy-3-(prop-2-enoxymethyl)quinoline
CID 54939655
3-ethyl-7-methoxy-2-methylquinoline
CID 90882709
(3,7-diethylquinolin-2-yl)hydrazine
CID 39346167
(2-amino-7-methoxyquinolin-3-yl)methanol
CID 62194670

Frequently Asked Questions

What is the IUPAC name of [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine?
The IUPAC name of [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine (CID 62245819) is [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine.
What is the SMILES notation for [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine?
The canonical SMILES for [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine is CCOCc1cc2ccc(OC)cc2nc1NN.
What is the InChIKey of [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine?
The InChIKey is NKDUYQYEGWPVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-3-18-8-10-6-9-4-5-11(17-2)7-12(9)15-13(10)16-14/h4-7H,3,8,14H2,1-2H3,(H,15,16).
What are the key properties of [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine?
[3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine has a molecular weight of 247.30 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(ethoxymethyl)-7-methoxyquinolin-2-yl]hydrazine is sourced from PubChem (CID 62245819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).