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

C17H26N4 — CID 62245538

IUPACN-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine
SMILESCC(C)CN(Cc1cc2ccccc2nc1NN)C(C)C
InChIInChI=1S/C17H26N4/c1-12(2)10-21(13(3)4)11-15-9-14-7-5-6-8-16(14)19-17(15)20-18/h5-9,12-13H,10-11,18H2,1-4H3,(H,19,20)
InChIKeyKKFNNFZIUBKCKX-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.39
Rot. Bonds6

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

N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine (PubChem CID 62245538) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound NameN-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine
PubChem CID62245538
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC NameN-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine
SMILESCC(C)CN(Cc1cc2ccccc2nc1NN)C(C)C
InChIInChI=1S/C17H26N4/c1-12(2)10-21(13(3)4)11-15-9-14-7-5-6-8-16(14)19-17(15)20-18/h5-9,12-13H,10-11,18H2,1-4H3,(H,19,20)
InChIKeyKKFNNFZIUBKCKX-UHFFFAOYSA-N
XLogP3.39
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.39
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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Frequently Asked Questions

What is the IUPAC name of N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine?
The IUPAC name of N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine (CID 62245538) is N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine?
The canonical SMILES for N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine is CC(C)CN(Cc1cc2ccccc2nc1NN)C(C)C.
What is the InChIKey of N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine?
The InChIKey is KKFNNFZIUBKCKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-12(2)10-21(13(3)4)11-15-9-14-7-5-6-8-16(14)19-17(15)20-18/h5-9,12-13H,10-11,18H2,1-4H3,(H,19,20).
What are the key properties of N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine?
N-[(2-hydrazinylquinolin-3-yl)methyl]-2-methyl-N-propan-2-ylpropan-1-amine has a molecular weight of 286.42 g/mol, XLogP of 3.39, 6 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]-2-methyl-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 62245538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).