[1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol

C15H20N4O — CID 62246844

IUPAC[1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol
SMILESNNc1nc2ccccc2cc1CN1CCCC1CO
InChIInChI=1S/C15H20N4O/c16-18-15-12(9-19-7-3-5-13(19)10-20)8-11-4-1-2-6-14(11)17-15/h1-2,4,6,8,13,20H,3,5,7,9-10,16H2,(H,17,18)
InChIKeyDDQWWRCHEFZJHZ-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.48
Rot. Bonds4

About [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol

[1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 62246844) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol
PubChem CID62246844
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol
SMILESNNc1nc2ccccc2cc1CN1CCCC1CO
InChIInChI=1S/C15H20N4O/c16-18-15-12(9-19-7-3-5-13(19)10-20)8-11-4-1-2-6-14(11)17-15/h1-2,4,6,8,13,20H,3,5,7,9-10,16H2,(H,17,18)
InChIKeyDDQWWRCHEFZJHZ-UHFFFAOYSA-N
XLogP1.48
TPSA74.41 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.48
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol (CID 62246844) is [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol is NNc1nc2ccccc2cc1CN1CCCC1CO.
What is the InChIKey of [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is DDQWWRCHEFZJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-18-15-12(9-19-7-3-5-13(19)10-20)8-11-4-1-2-6-14(11)17-15/h1-2,4,6,8,13,20H,3,5,7,9-10,16H2,(H,17,18).
What are the key properties of [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol?
[1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 272.35 g/mol, XLogP of 1.48, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-hydrazinylquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 62246844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).