N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine

About N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine

N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine (PubChem CID 163930059) has the molecular formula C14H26N4O4-2 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine.

Molecular Properties

Compound Name	N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine
PubChem CID	163930059
Molecular Formula	C14H26N4O4-2
Molecular Weight	314.39 g/mol
Exact Mass	314.20
IUPAC Name	N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine
SMILES	CN([O-])ONCC1CC2C3CC(CNON(C)[O-])C(C3)C2C1
InChI	InChI=1S/C14H26N4O4/c1-17(19)21-15-7-9-3-12-10-5-11(8-16-22-18(2)20)13(6-10)14(12)4-9/h9-16H,3-8H2,1-2H3/q-2
InChIKey	ZOGVPEOHZWIWSF-UHFFFAOYSA-N
XLogP	1.02
TPSA	95.12 Å²
H-Bond Donors	2
H-Bond Acceptors	8
Rotatable Bonds	8
Heavy Atoms	22
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	314.39
LogP ≤ 5	1.02
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine?

The IUPAC name of N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine (CID 163930059) is N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine.

What is the SMILES notation for N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine?

The canonical SMILES for N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine is CN([O-])ONCC1CC2C3CC(CNON(C)[O-])C(C3)C2C1.

What is the InChIKey of N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine?

The InChIKey is ZOGVPEOHZWIWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O4/c1-17(19)21-15-7-9-3-12-10-5-11(8-16-22-18(2)20)13(6-10)14(12)4-9/h9-16H,3-8H2,1-2H3/q-2.

What are the key properties of N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine?

N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine has a molecular weight of 314.39 g/mol, XLogP of 1.02, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[methyl(oxido)amino]oxy-1-[8-[[[methyl(oxido)amino]oxyamino]methyl]-4-tricyclo[5.2.1.02,6]decanyl]methanamine is sourced from PubChem (CID 163930059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).