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

C16H20N4O — CID 63375198

IUPAC(4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)c2cc(NN)c3ccccc3n2)C1
InChIInChI=1S/C16H20N4O/c1-11-5-4-8-20(10-11)16(21)15-9-14(19-17)12-6-2-3-7-13(12)18-15/h2-3,6-7,9,11H,4-5,8,10,17H2,1H3,(H,18,19)
InChIKeyFXMWPFVWHGDIKZ-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.39
Rot. Bonds2

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

(4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone (PubChem CID 63375198) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone
PubChem CID63375198
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name(4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)c2cc(NN)c3ccccc3n2)C1
InChIInChI=1S/C16H20N4O/c1-11-5-4-8-20(10-11)16(21)15-9-14(19-17)12-6-2-3-7-13(12)18-15/h2-3,6-7,9,11H,4-5,8,10,17H2,1H3,(H,18,19)
InChIKeyFXMWPFVWHGDIKZ-UHFFFAOYSA-N
XLogP2.39
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.39
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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Related Compounds

(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 63375065
(4-hydrazinylquinolin-2-yl)-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone
CID 103358352
[3-(methylamino)piperidin-1-yl]-(4-methylquinolin-2-yl)methanone
CID 119488384
[4-(ethylamino)quinolin-2-yl]-(3-hydroxypyrrolidin-1-yl)methanone
CID 63375602
(3-methylpiperidin-1-yl)-(3-methylquinoxalin-2-yl)methanone
CID 110856129
[(3S)-3-(methylaminomethyl)piperidin-1-yl]-(4-methylquinolin-2-yl)methanone
CID 124594515
(4-chloroquinolin-2-yl)-(3-methylazetidin-1-yl)methanone
CID 167993187
N-(2-aminoethyl)-1-(4-methylquinoline-2-carbonyl)piperidine-3-carboxamide
CID 126791837
[4-(3,4-dimethoxyanilino)-6,7-dimethoxyquinolin-2-yl]-[(3S)-3-methylpiperidin-1-yl]methanone
CID 95050803
[4-(2,5-difluoroanilino)quinolin-2-yl]-(4-methylpiperidin-1-yl)methanone
CID 53020925
(4-hydrazinyl-3-methylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 63212098
(4-chloroquinolin-2-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 63376375

Frequently Asked Questions

What is the IUPAC name of (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone (CID 63375198) is (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone is CC1CCCN(C(=O)c2cc(NN)c3ccccc3n2)C1.
What is the InChIKey of (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone?
The InChIKey is FXMWPFVWHGDIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-11-5-4-8-20(10-11)16(21)15-9-14(19-17)12-6-2-3-7-13(12)18-15/h2-3,6-7,9,11H,4-5,8,10,17H2,1H3,(H,18,19).
What are the key properties of (4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone?
(4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone has a molecular weight of 284.36 g/mol, XLogP of 2.39, 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-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 63375198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).