(2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine

C12H23NO — CID 70228439

IUPAC(2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine
SMILESCOC(C1CCCCC1)[C@H]1CCCN1
InChIInChI=1S/C12H23NO/c1-14-12(11-8-5-9-13-11)10-6-3-2-4-7-10/h10-13H,2-9H2,1H3/t11-,12?/m1/s1
InChIKeyZQMKZHPGYYXLOV-JHJMLUEUSA-N
MW197.32 g/mol
LogP2.33
Rot. Bonds3

About (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine

(2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine (PubChem CID 70228439) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine
PubChem CID70228439
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name(2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine
SMILESCOC(C1CCCCC1)[C@H]1CCCN1
InChIInChI=1S/C12H23NO/c1-14-12(11-8-5-9-13-11)10-6-3-2-4-7-10/h10-13H,2-9H2,1H3/t11-,12?/m1/s1
InChIKeyZQMKZHPGYYXLOV-JHJMLUEUSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine?
The IUPAC name of (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine (CID 70228439) is (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine.
What is the SMILES notation for (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine?
The canonical SMILES for (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine is COC(C1CCCCC1)[C@H]1CCCN1.
What is the InChIKey of (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine?
The InChIKey is ZQMKZHPGYYXLOV-JHJMLUEUSA-N. The full InChI is InChI=1S/C12H23NO/c1-14-12(11-8-5-9-13-11)10-6-3-2-4-7-10/h10-13H,2-9H2,1H3/t11-,12?/m1/s1.
What are the key properties of (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine?
(2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine has a molecular weight of 197.32 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[cyclohexyl(methoxy)methyl]pyrrolidine is sourced from PubChem (CID 70228439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).