1-[(3-methyloxetan-3-yl)methyl]pyrrolidine

C9H17NO — CID 130161357

IUPAC1-[(3-methyloxetan-3-yl)methyl]pyrrolidine
SMILESCC1(CN2CCCC2)COC1
InChIInChI=1S/C9H17NO/c1-9(7-11-8-9)6-10-4-2-3-5-10/h2-8H2,1H3
InChIKeyDLENAMJZIMXJNY-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.12
Rot. Bonds2

About 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine

1-[(3-methyloxetan-3-yl)methyl]pyrrolidine (PubChem CID 130161357) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine.

Molecular Properties

Compound Name1-[(3-methyloxetan-3-yl)methyl]pyrrolidine
PubChem CID130161357
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-[(3-methyloxetan-3-yl)methyl]pyrrolidine
SMILESCC1(CN2CCCC2)COC1
InChIInChI=1S/C9H17NO/c1-9(7-11-8-9)6-10-4-2-3-5-10/h2-8H2,1H3
InChIKeyDLENAMJZIMXJNY-UHFFFAOYSA-N
XLogP1.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
The IUPAC name of 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine (CID 130161357) is 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine.
What is the SMILES notation for 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
The canonical SMILES for 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine is CC1(CN2CCCC2)COC1.
What is the InChIKey of 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
The InChIKey is DLENAMJZIMXJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-9(7-11-8-9)6-10-4-2-3-5-10/h2-8H2,1H3.
What are the key properties of 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
1-[(3-methyloxetan-3-yl)methyl]pyrrolidine has a molecular weight of 155.24 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methyloxetan-3-yl)methyl]pyrrolidine is sourced from PubChem (CID 130161357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).