3-(methoxymethyl)-2-propan-2-ylazetidine

C8H17NO — CID 105428526

IUPAC3-(methoxymethyl)-2-propan-2-ylazetidine
SMILESCOCC1CNC1C(C)C
InChIInChI=1S/C8H17NO/c1-6(2)8-7(4-9-8)5-10-3/h6-9H,4-5H2,1-3H3
InChIKeySZCAXQHQGLDAOS-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.88
Rot. Bonds3

About 3-(methoxymethyl)-2-propan-2-ylazetidine

3-(methoxymethyl)-2-propan-2-ylazetidine (PubChem CID 105428526) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3-(methoxymethyl)-2-propan-2-ylazetidine.

Molecular Properties

Compound Name3-(methoxymethyl)-2-propan-2-ylazetidine
PubChem CID105428526
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3-(methoxymethyl)-2-propan-2-ylazetidine
SMILESCOCC1CNC1C(C)C
InChIInChI=1S/C8H17NO/c1-6(2)8-7(4-9-8)5-10-3/h6-9H,4-5H2,1-3H3
InChIKeySZCAXQHQGLDAOS-UHFFFAOYSA-N
XLogP0.88
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(methoxymethyl)-2-propan-2-ylpyrrolidine
CID 105430787
(2S,3R,4R)-3-(2-methoxyethyl)-2,4-bis(methoxymethyl)pyrrolidine
CID 15330691
5-(methoxymethyl)-2-propan-2-ylpiperidine
CID 105434920
(3R,4R)-4-(methoxymethyl)pyrrolidin-3-ol
CID 11182838
3-(methoxymethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole
CID 170906267
(2S,4S)-4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 119057051
4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 122236424
2-(methoxymethyl)-5-propan-2-ylmorpholine
CID 79246310
2-(methoxymethyl)-2,5-dihydro-1H-pyrrole;hydrochloride
CID 146121133
3-ethyl-2-propan-2-ylpyrrolidine
CID 4239947
trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine
CID 131115476
2-(methoxymethyl)piperazine;dihydrochloride
CID 66941255

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-2-propan-2-ylazetidine?
The IUPAC name of 3-(methoxymethyl)-2-propan-2-ylazetidine (CID 105428526) is 3-(methoxymethyl)-2-propan-2-ylazetidine.
What is the SMILES notation for 3-(methoxymethyl)-2-propan-2-ylazetidine?
The canonical SMILES for 3-(methoxymethyl)-2-propan-2-ylazetidine is COCC1CNC1C(C)C.
What is the InChIKey of 3-(methoxymethyl)-2-propan-2-ylazetidine?
The InChIKey is SZCAXQHQGLDAOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-6(2)8-7(4-9-8)5-10-3/h6-9H,4-5H2,1-3H3.
What are the key properties of 3-(methoxymethyl)-2-propan-2-ylazetidine?
3-(methoxymethyl)-2-propan-2-ylazetidine has a molecular weight of 143.23 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-2-propan-2-ylazetidine is sourced from PubChem (CID 105428526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).