ethoxymethanamine;methane

C6H21NO — CID 162196031

IUPACethoxymethanamine;methane
SMILESC.C.C.CCOCN
InChIInChI=1S/C3H9NO.3CH4/c1-2-5-3-4;;;/h2-4H2,1H3;3*1H4
InChIKeyZQYHCNYGWYELTQ-UHFFFAOYSA-N
MW123.24 g/mol
LogP1.85
Rot. Bonds2

About ethoxymethanamine;methane

ethoxymethanamine;methane (PubChem CID 162196031) has the molecular formula C6H21NO and a molecular weight of 123.24 g/mol. Its IUPAC name is ethoxymethanamine;methane.

Molecular Properties

Compound Nameethoxymethanamine;methane
PubChem CID162196031
Molecular FormulaC6H21NO
Molecular Weight123.24 g/mol
Exact Mass123.16
IUPAC Nameethoxymethanamine;methane
SMILESC.C.C.CCOCN
InChIInChI=1S/C3H9NO.3CH4/c1-2-5-3-4;;;/h2-4H2,1H3;3*1H4
InChIKeyZQYHCNYGWYELTQ-UHFFFAOYSA-N
XLogP1.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.24
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

ethoxymethoxymethanamine
CID 23400789
ethanamine;ethoxyethane
CID 87409390
4-ethoxybutoxymethanamine
CID 87914089
ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethoxyethane;hydroxylamine
CID 135816400
ethoxyethane;sulfane
CID 87243372
ethoxyethane;sulfane
CID 90240371
ethoxyethane;pentahydrate
CID 141041283
disodium;ethoxyethane
CID 23107014
ethoxyethane;hydrate
CID 22594236
azane;ethoxyethane;hydroxylamine
CID 173273228

Frequently Asked Questions

What is the IUPAC name of ethoxymethanamine;methane?
The IUPAC name of ethoxymethanamine;methane (CID 162196031) is ethoxymethanamine;methane.
What is the SMILES notation for ethoxymethanamine;methane?
The canonical SMILES for ethoxymethanamine;methane is C.C.C.CCOCN.
What is the InChIKey of ethoxymethanamine;methane?
The InChIKey is ZQYHCNYGWYELTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO.3CH4/c1-2-5-3-4;;;/h2-4H2,1H3;3*1H4.
What are the key properties of ethoxymethanamine;methane?
ethoxymethanamine;methane has a molecular weight of 123.24 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxymethanamine;methane is sourced from PubChem (CID 162196031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).