methyl(2-prop-2-enoxyethyl)azanide

C6H12NO- — CID 155624696

IUPACmethyl(2-prop-2-enoxyethyl)azanide
SMILESC=CCOCC[N-]C
InChIInChI=1S/C6H12NO/c1-3-5-8-6-4-7-2/h3H,1,4-6H2,2H3/q-1
InChIKeyZMSVLMILRKCCOL-UHFFFAOYSA-N
MW114.17 g/mol
LogP1.19
Rot. Bonds5

About methyl(2-prop-2-enoxyethyl)azanide

methyl(2-prop-2-enoxyethyl)azanide (PubChem CID 155624696) has the molecular formula C6H12NO- and a molecular weight of 114.17 g/mol. Its IUPAC name is methyl(2-prop-2-enoxyethyl)azanide.

Molecular Properties

Compound Namemethyl(2-prop-2-enoxyethyl)azanide
PubChem CID155624696
Molecular FormulaC6H12NO-
Molecular Weight114.17 g/mol
Exact Mass114.09
IUPAC Namemethyl(2-prop-2-enoxyethyl)azanide
SMILESC=CCOCC[N-]C
InChIInChI=1S/C6H12NO/c1-3-5-8-6-4-7-2/h3H,1,4-6H2,2H3/q-1
InChIKeyZMSVLMILRKCCOL-UHFFFAOYSA-N
XLogP1.19
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.17
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Allylamine, 2-(allyloxy)-N,N-dimethyl-
CID 45075
N,N-Diethyl-2-[(prop-2-en-1-yl)oxy]ethan-1-amine
CID 261282
n,n-Dimethyl-2-(prop-2-en-1-yloxy)ethanamine
CID 261277
Methyl[2-(prop-2-en-1-yloxy)ethyl]amine hydrochloride
CID 154803684
Allylcholine chloride
CID 88426392
Methyl[2-(prop-2-en-1-yloxy)ethyl]amine
CID 58684300
N-butyl-N-(2-prop-2-enoxyethyl)butan-1-amine
CID 261300
Trimethyl(2-prop-2-enyloxyethyl)amine
CID 2317160
N-methyl-2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine
CID 22899058
N,N-dimethyl-1-prop-2-enoxyethanamine
CID 22916505
2-buta-1,3-dien-2-yloxy-N,N-dimethylethanamine
CID 60138442
N-ethyl-2-prop-2-enoxyethanamine
CID 62336850

Frequently Asked Questions

What is the IUPAC name of methyl(2-prop-2-enoxyethyl)azanide?
The IUPAC name of methyl(2-prop-2-enoxyethyl)azanide (CID 155624696) is methyl(2-prop-2-enoxyethyl)azanide.
What is the SMILES notation for methyl(2-prop-2-enoxyethyl)azanide?
The canonical SMILES for methyl(2-prop-2-enoxyethyl)azanide is C=CCOCC[N-]C.
What is the InChIKey of methyl(2-prop-2-enoxyethyl)azanide?
The InChIKey is ZMSVLMILRKCCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12NO/c1-3-5-8-6-4-7-2/h3H,1,4-6H2,2H3/q-1.
What are the key properties of methyl(2-prop-2-enoxyethyl)azanide?
methyl(2-prop-2-enoxyethyl)azanide has a molecular weight of 114.17 g/mol, XLogP of 1.19, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(2-prop-2-enoxyethyl)azanide is sourced from PubChem (CID 155624696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).