N,N-bis(methoxyamino)methanamine

C3H11N3O2 — CID 157154741

IUPACN,N-bis(methoxyamino)methanamine
SMILESCONN(C)NOC
InChIInChI=1S/C3H11N3O2/c1-6(4-7-2)5-8-3/h4-5H,1-3H3
InChIKeyALRGMKNQYKDVLO-UHFFFAOYSA-N
MW121.14 g/mol
LogP-0.95
Rot. Bonds4

About N,N-bis(methoxyamino)methanamine

N,N-bis(methoxyamino)methanamine (PubChem CID 157154741) has the molecular formula C3H11N3O2 and a molecular weight of 121.14 g/mol. Its IUPAC name is N,N-bis(methoxyamino)methanamine.

Molecular Properties

Compound NameN,N-bis(methoxyamino)methanamine
PubChem CID157154741
Molecular FormulaC3H11N3O2
Molecular Weight121.14 g/mol
Exact Mass121.09
IUPAC NameN,N-bis(methoxyamino)methanamine
SMILESCONN(C)NOC
InChIInChI=1S/C3H11N3O2/c1-6(4-7-2)5-8-3/h4-5H,1-3H3
InChIKeyALRGMKNQYKDVLO-UHFFFAOYSA-N
XLogP-0.95
TPSA45.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.14
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(methoxyamino)methanamine?
The IUPAC name of N,N-bis(methoxyamino)methanamine (CID 157154741) is N,N-bis(methoxyamino)methanamine.
What is the SMILES notation for N,N-bis(methoxyamino)methanamine?
The canonical SMILES for N,N-bis(methoxyamino)methanamine is CONN(C)NOC.
What is the InChIKey of N,N-bis(methoxyamino)methanamine?
The InChIKey is ALRGMKNQYKDVLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H11N3O2/c1-6(4-7-2)5-8-3/h4-5H,1-3H3.
What are the key properties of N,N-bis(methoxyamino)methanamine?
N,N-bis(methoxyamino)methanamine has a molecular weight of 121.14 g/mol, XLogP of -0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(methoxyamino)methanamine is sourced from PubChem (CID 157154741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).