N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine

C16H24N4 — CID 62244445

IUPACN-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine
SMILESCCCCCN(C)Cc1cc2ccccc2nc1NN
InChIInChI=1S/C16H24N4/c1-3-4-7-10-20(2)12-14-11-13-8-5-6-9-15(13)18-16(14)19-17/h5-6,8-9,11H,3-4,7,10,12,17H2,1-2H3,(H,18,19)
InChIKeyVXLGPDCECFQBGG-UHFFFAOYSA-N
MW272.40 g/mol
LogP3.14
Rot. Bonds7

About N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine

N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine (PubChem CID 62244445) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine.

Molecular Properties

Compound NameN-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine
PubChem CID62244445
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC NameN-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine
SMILESCCCCCN(C)Cc1cc2ccccc2nc1NN
InChIInChI=1S/C16H24N4/c1-3-4-7-10-20(2)12-14-11-13-8-5-6-9-15(13)18-16(14)19-17/h5-6,8-9,11H,3-4,7,10,12,17H2,1-2H3,(H,18,19)
InChIKeyVXLGPDCECFQBGG-UHFFFAOYSA-N
XLogP3.14
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2-hydrazinylquinolin-3-yl)methyl]-3-methoxy-N-methylpropan-1-amine
CID 63008100
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methyl-2-methylsulfanylethanamine
CID 112664442
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 63865938
2-[(2-hydrazinylquinolin-3-yl)methyl-methylamino]-N-methylacetamide
CID 62241968
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methyl-2-propan-2-yloxyethanamine
CID 81063048
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-propan-2-ylpropan-1-amine
CID 62245580
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methyl-1-methylsulfanylbutan-2-amine
CID 115987394
N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine
CID 62245538
3-[[2-ethoxyethyl(methyl)amino]methyl]-N-methylquinolin-2-amine
CID 81074205
3-[methyl-[[2-(propylamino)quinolin-3-yl]methyl]amino]propanenitrile
CID 62177689
N-(cyclopropylmethyl)-N-[(2-hydrazinylquinolin-3-yl)methyl]propan-2-amine
CID 62244404
3-[methyl-[[2-(methylamino)quinolin-3-yl]methyl]amino]propanenitrile
CID 62177687

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine?
The IUPAC name of N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine (CID 62244445) is N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine.
What is the SMILES notation for N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine?
The canonical SMILES for N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine is CCCCCN(C)Cc1cc2ccccc2nc1NN.
What is the InChIKey of N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine?
The InChIKey is VXLGPDCECFQBGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-3-4-7-10-20(2)12-14-11-13-8-5-6-9-15(13)18-16(14)19-17/h5-6,8-9,11H,3-4,7,10,12,17H2,1-2H3,(H,18,19).
What are the key properties of N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine?
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine has a molecular weight of 272.40 g/mol, XLogP of 3.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methylpentan-1-amine is sourced from PubChem (CID 62244445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).