(3S)-3-(2-cyclobutylethoxy)pyrrolidine

C10H19NO — CID 106201873

IUPAC(3S)-3-(2-cyclobutylethoxy)pyrrolidine
SMILESC1CC(CCO[C@H]2CCNC2)C1
InChIInChI=1S/C10H19NO/c1-2-9(3-1)5-7-12-10-4-6-11-8-10/h9-11H,1-8H2/t10-/m0/s1
InChIKeyLNQAPVUJQHDCFL-JTQLQIEISA-N
MW169.27 g/mol
LogP1.56
Rot. Bonds4

About (3S)-3-(2-cyclobutylethoxy)pyrrolidine

(3S)-3-(2-cyclobutylethoxy)pyrrolidine (PubChem CID 106201873) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (3S)-3-(2-cyclobutylethoxy)pyrrolidine.

Molecular Properties

Compound Name(3S)-3-(2-cyclobutylethoxy)pyrrolidine
PubChem CID106201873
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(3S)-3-(2-cyclobutylethoxy)pyrrolidine
SMILESC1CC(CCO[C@H]2CCNC2)C1
InChIInChI=1S/C10H19NO/c1-2-9(3-1)5-7-12-10-4-6-11-8-10/h9-11H,1-8H2/t10-/m0/s1
InChIKeyLNQAPVUJQHDCFL-JTQLQIEISA-N
XLogP1.56
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 ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-(2-cyclohexylethoxy)pyrrolidine
CID 26191806
(3R)-3-(2-cyclopropylethoxy)pyrrolidine
CID 97000060
3-(cyclobutylmethoxy)pyrrolidine;hydrochloride
CID 53409349
4-(2-cyclopentyloxyethyl)piperidine
CID 43149930
3-(cyclohexylmethoxy)pyrrolidine
CID 45075453
(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine
CID 82955468
3-[2-(3-ethylcyclohexyl)oxyethyl]pyrrolidine
CID 114796060
(3R)-3-propoxypyrrolidine;hydrochloride
CID 138393556
3-(2-methoxyethoxy)pyrrolidine
CID 18337162
4-[2-(4-ethylcyclohexyl)ethoxy]piperidine
CID 176984075
2-cyclobutylethyl 3-piperidin-4-yloxypropanoate
CID 106203080
3-[2-(3-methylcyclohexyl)oxyethyl]piperidine
CID 62355843

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(2-cyclobutylethoxy)pyrrolidine?
The IUPAC name of (3S)-3-(2-cyclobutylethoxy)pyrrolidine (CID 106201873) is (3S)-3-(2-cyclobutylethoxy)pyrrolidine.
What is the SMILES notation for (3S)-3-(2-cyclobutylethoxy)pyrrolidine?
The canonical SMILES for (3S)-3-(2-cyclobutylethoxy)pyrrolidine is C1CC(CCO[C@H]2CCNC2)C1.
What is the InChIKey of (3S)-3-(2-cyclobutylethoxy)pyrrolidine?
The InChIKey is LNQAPVUJQHDCFL-JTQLQIEISA-N. The full InChI is InChI=1S/C10H19NO/c1-2-9(3-1)5-7-12-10-4-6-11-8-10/h9-11H,1-8H2/t10-/m0/s1.
What are the key properties of (3S)-3-(2-cyclobutylethoxy)pyrrolidine?
(3S)-3-(2-cyclobutylethoxy)pyrrolidine has a molecular weight of 169.27 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(2-cyclobutylethoxy)pyrrolidine is sourced from PubChem (CID 106201873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).