(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine

C10H19NO — CID 86321931

IUPAC(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine
SMILESC1CC(COC[C@H]2CCNC2)C1
InChIInChI=1S/C10H19NO/c1-2-9(3-1)7-12-8-10-4-5-11-6-10/h9-11H,1-8H2/t10-/m0/s1
InChIKeyRVPGSDBMMJTELP-JTQLQIEISA-N
MW169.27 g/mol
LogP1.41
Rot. Bonds4

About (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine

(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine (PubChem CID 86321931) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine.

Molecular Properties

Compound Name(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine
PubChem CID86321931
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine
SMILESC1CC(COC[C@H]2CCNC2)C1
InChIInChI=1S/C10H19NO/c1-2-9(3-1)7-12-8-10-4-5-11-6-10/h9-11H,1-8H2/t10-/m0/s1
InChIKeyRVPGSDBMMJTELP-JTQLQIEISA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(cyclopropylmethoxymethoxymethyl)pyrrolidine
CID 106938116
3-(cyclopropylmethoxymethoxymethyl)piperidine
CID 106937752
3-(oxan-4-ylmethoxymethyl)piperidine
CID 62383187
3-[2-(cyclobutylmethoxy)ethyl]piperidine
CID 56830620
3-(oxolan-2-ylmethoxymethyl)pyrrolidine
CID 62372457
(3R)-3-(ethoxymethyl)piperidine
CID 42427178
(3R)-3-(2-fluoroethoxymethyl)pyrrolidine
CID 86320647
(3S)-3-(ethoxymethyl)piperidine
CID 42427180
3-(ethoxymethyl)piperidine;hydrochloride
CID 17178071
3-[(2,2-difluorocyclopropyl)methoxymethyl]piperidine
CID 126845147
(3S)-3-(2-propoxyethoxymethyl)pyrrolidine
CID 86320893
3-(2-ethoxyethoxymethyl)pyrrolidine;hydrochloride
CID 56829885

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine?
The IUPAC name of (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine (CID 86321931) is (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine.
What is the SMILES notation for (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine?
The canonical SMILES for (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine is C1CC(COC[C@H]2CCNC2)C1.
What is the InChIKey of (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine?
The InChIKey is RVPGSDBMMJTELP-JTQLQIEISA-N. The full InChI is InChI=1S/C10H19NO/c1-2-9(3-1)7-12-8-10-4-5-11-6-10/h9-11H,1-8H2/t10-/m0/s1.
What are the key properties of (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine?
(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine has a molecular weight of 169.27 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(cyclobutylmethoxymethyl)pyrrolidine is sourced from PubChem (CID 86321931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).