(3R)-3-(2-cyclohexylethoxy)pyrrolidine

C12H23NO — CID 26191806

IUPAC(3R)-3-(2-cyclohexylethoxy)pyrrolidine
SMILESC1CCC(CCO[C@@H]2CCNC2)CC1
InChIInChI=1S/C12H23NO/c1-2-4-11(5-3-1)7-9-14-12-6-8-13-10-12/h11-13H,1-10H2/t12-/m1/s1
InChIKeyUFSRMGOWOSUGOH-GFCCVEGCSA-N
MW197.32 g/mol
LogP2.34
Rot. Bonds4

About (3R)-3-(2-cyclohexylethoxy)pyrrolidine

(3R)-3-(2-cyclohexylethoxy)pyrrolidine (PubChem CID 26191806) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is (3R)-3-(2-cyclohexylethoxy)pyrrolidine.

Molecular Properties

Compound Name(3R)-3-(2-cyclohexylethoxy)pyrrolidine
PubChem CID26191806
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name(3R)-3-(2-cyclohexylethoxy)pyrrolidine
SMILESC1CCC(CCO[C@@H]2CCNC2)CC1
InChIInChI=1S/C12H23NO/c1-2-4-11(5-3-1)7-9-14-12-6-8-13-10-12/h11-13H,1-10H2/t12-/m1/s1
InChIKeyUFSRMGOWOSUGOH-GFCCVEGCSA-N
XLogP2.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(2-cyclobutylethoxy)pyrrolidine
CID 106201873
(3R)-3-(2-cyclopropylethoxy)pyrrolidine
CID 97000060
3-(cyclohexylmethoxy)pyrrolidine
CID 45075453
4-(2-cyclopentyloxyethyl)piperidine
CID 43149930
3-(cyclobutylmethoxy)pyrrolidine;hydrochloride
CID 53409349
(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine
CID 82955468
3-(2-cyclohexylethyl)pyrrolidine
CID 53409214
(3R)-3-propoxypyrrolidine;hydrochloride
CID 138393556
3-(2-methoxyethoxy)pyrrolidine
CID 18337162
4-[2-(4-ethylcyclohexyl)ethoxy]piperidine
CID 176984075
3-[2-(3-ethylcyclohexyl)oxyethyl]pyrrolidine
CID 114796060
4-[2-(cyclohexylmethoxy)ethyl]piperidine
CID 62383196

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(2-cyclohexylethoxy)pyrrolidine?
The IUPAC name of (3R)-3-(2-cyclohexylethoxy)pyrrolidine (CID 26191806) is (3R)-3-(2-cyclohexylethoxy)pyrrolidine.
What is the SMILES notation for (3R)-3-(2-cyclohexylethoxy)pyrrolidine?
The canonical SMILES for (3R)-3-(2-cyclohexylethoxy)pyrrolidine is C1CCC(CCO[C@@H]2CCNC2)CC1.
What is the InChIKey of (3R)-3-(2-cyclohexylethoxy)pyrrolidine?
The InChIKey is UFSRMGOWOSUGOH-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H23NO/c1-2-4-11(5-3-1)7-9-14-12-6-8-13-10-12/h11-13H,1-10H2/t12-/m1/s1.
What are the key properties of (3R)-3-(2-cyclohexylethoxy)pyrrolidine?
(3R)-3-(2-cyclohexylethoxy)pyrrolidine has a molecular weight of 197.32 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(2-cyclohexylethoxy)pyrrolidine is sourced from PubChem (CID 26191806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).