N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine

C8H15NO — CID 131160434

IUPACN-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine
SMILESC=C(C)CN(C)C1COC1
InChIInChI=1S/C8H15NO/c1-7(2)4-9(3)8-5-10-6-8/h8H,1,4-6H2,2-3H3
InChIKeyGZGSIPVNFJCUJT-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.89
Rot. Bonds3

About N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine

N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine (PubChem CID 131160434) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine.

Molecular Properties

Compound NameN-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine
PubChem CID131160434
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine
SMILESC=C(C)CN(C)C1COC1
InChIInChI=1S/C8H15NO/c1-7(2)4-9(3)8-5-10-6-8/h8H,1,4-6H2,2-3H3
InChIKeyGZGSIPVNFJCUJT-UHFFFAOYSA-N
XLogP0.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine?
The IUPAC name of N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine (CID 131160434) is N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine.
What is the SMILES notation for N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine?
The canonical SMILES for N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine is C=C(C)CN(C)C1COC1.
What is the InChIKey of N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine?
The InChIKey is GZGSIPVNFJCUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-7(2)4-9(3)8-5-10-6-8/h8H,1,4-6H2,2-3H3.
What are the key properties of N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine?
N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine has a molecular weight of 141.21 g/mol, XLogP of 0.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylprop-2-enyl)oxetan-3-amine is sourced from PubChem (CID 131160434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).