(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone

C15H18N4O — CID 63375065

IUPAC(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2cc(NN)c3ccccc3n2)C1
InChIInChI=1S/C15H18N4O/c1-10-6-7-19(9-10)15(20)14-8-13(18-16)11-4-2-3-5-12(11)17-14/h2-5,8,10H,6-7,9,16H2,1H3,(H,17,18)
InChIKeyZWOXYFFQADUXOZ-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.00
Rot. Bonds2

About (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone

(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone (PubChem CID 63375065) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone
PubChem CID63375065
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2cc(NN)c3ccccc3n2)C1
InChIInChI=1S/C15H18N4O/c1-10-6-7-19(9-10)15(20)14-8-13(18-16)11-4-2-3-5-12(11)17-14/h2-5,8,10H,6-7,9,16H2,1H3,(H,17,18)
InChIKeyZWOXYFFQADUXOZ-UHFFFAOYSA-N
XLogP2.00
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.00
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 (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone?
The IUPAC name of (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone (CID 63375065) is (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone is CC1CCN(C(=O)c2cc(NN)c3ccccc3n2)C1.
What is the InChIKey of (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone?
The InChIKey is ZWOXYFFQADUXOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-10-6-7-19(9-10)15(20)14-8-13(18-16)11-4-2-3-5-12(11)17-14/h2-5,8,10H,6-7,9,16H2,1H3,(H,17,18).
What are the key properties of (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone?
(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone has a molecular weight of 270.34 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 63375065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).