1-cyclohexyl-3-methoxypyrrolidine

C11H21NO — CID 154019623

IUPAC1-cyclohexyl-3-methoxypyrrolidine
SMILESCOC1CCN(C2CCCCC2)C1
InChIInChI=1S/C11H21NO/c1-13-11-7-8-12(9-11)10-5-3-2-4-6-10/h10-11H,2-9H2,1H3
InChIKeyARAJTKDSWJJWFG-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.04
Rot. Bonds2

About 1-cyclohexyl-3-methoxypyrrolidine

1-cyclohexyl-3-methoxypyrrolidine (PubChem CID 154019623) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-cyclohexyl-3-methoxypyrrolidine.

Molecular Properties

Compound Name1-cyclohexyl-3-methoxypyrrolidine
PubChem CID154019623
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-cyclohexyl-3-methoxypyrrolidine
SMILESCOC1CCN(C2CCCCC2)C1
InChIInChI=1S/C11H21NO/c1-13-11-7-8-12(9-11)10-5-3-2-4-6-10/h10-11H,2-9H2,1H3
InChIKeyARAJTKDSWJJWFG-UHFFFAOYSA-N
XLogP2.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 145325773
(2R,3R,4R)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153298351
(2R,3S,4S)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153298377
(2R,3R,4S)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153298911
(2R,3S,4R)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153306742
Oxazolidine, 3-cyclohexyl-5-methyl-
CID 337254
3-Cyclohexyl-6-oxa-3-azabicyclo[3.1.0]hexane
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1-Cyclohexylpyrrolidin-3-ol
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3-Cyclohexyl-1,3-oxazolidine
CID 13445990
N-methyl-N-(oxiran-2-ylmethyl)cyclohexanamine
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3-Cyclohexyloxy-1-methylpyrrolidine
CID 18723140
4-Methoxy-1,2-dimethylpyrrolidine
CID 20647910

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-methoxypyrrolidine?
The IUPAC name of 1-cyclohexyl-3-methoxypyrrolidine (CID 154019623) is 1-cyclohexyl-3-methoxypyrrolidine.
What is the SMILES notation for 1-cyclohexyl-3-methoxypyrrolidine?
The canonical SMILES for 1-cyclohexyl-3-methoxypyrrolidine is COC1CCN(C2CCCCC2)C1.
What is the InChIKey of 1-cyclohexyl-3-methoxypyrrolidine?
The InChIKey is ARAJTKDSWJJWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-13-11-7-8-12(9-11)10-5-3-2-4-6-10/h10-11H,2-9H2,1H3.
What are the key properties of 1-cyclohexyl-3-methoxypyrrolidine?
1-cyclohexyl-3-methoxypyrrolidine has a molecular weight of 183.29 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-methoxypyrrolidine is sourced from PubChem (CID 154019623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).