2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine

C9H19NO — CID 20765506

IUPAC2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
SMILESCC(C)(C)OCC1CCCN1
InChIInChI=1S/C9H19NO/c1-9(2,3)11-7-8-5-4-6-10-8/h8,10H,4-7H2,1-3H3
InChIKeyVWXSCKOHAKPRKK-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.55
Rot. Bonds2

About 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine

2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine (PubChem CID 20765506) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
PubChem CID20765506
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
SMILESCC(C)(C)OCC1CCCN1
InChIInChI=1S/C9H19NO/c1-9(2,3)11-7-8-5-4-6-10-8/h8,10H,4-7H2,1-3H3
InChIKeyVWXSCKOHAKPRKK-UHFFFAOYSA-N
XLogP1.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
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[(2S)-pyrrolidin-2-yl]methoxysilane
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O-(pyrrolidin-2-ylmethyl)hydroxylamine
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(2S)-2-(propan-2-yloxymethyl)pyrrolidine
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tert-butyl formate;[(2R)-pyrrolidin-2-yl]methyl carbonochloridate
CID 175149663
tert-butyl 2-formyl-3-pyrrolidin-2-ylpropanoate
CID 23223865
pyrrolidin-2-ylmethyl 2-methylpropanoate
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2-(2-fluoro-2-methylbutyl)pyrrolidine
CID 105431305
(2R)-2-(methoxymethyl)pyrrolidine;molecular hydrogen;propane
CID 143635962

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine (CID 20765506) is 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine is CC(C)(C)OCC1CCCN1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine?
The InChIKey is VWXSCKOHAKPRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-9(2,3)11-7-8-5-4-6-10-8/h8,10H,4-7H2,1-3H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine?
2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine has a molecular weight of 157.26 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine is sourced from PubChem (CID 20765506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).