2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine

C14H27NO2 — CID 176926874

IUPAC2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine
SMILESCOCC1CCCN1CC1(COC(C)C)CC1
InChIInChI=1S/C14H27NO2/c1-12(2)17-11-14(6-7-14)10-15-8-4-5-13(15)9-16-3/h12-13H,4-11H2,1-3H3
InChIKeyCIUXUUUKDRIVED-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.30
Rot. Bonds7

About 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine

2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine (PubChem CID 176926874) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine.

Molecular Properties

Compound Name2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine
PubChem CID176926874
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine
SMILESCOCC1CCCN1CC1(COC(C)C)CC1
InChIInChI=1S/C14H27NO2/c1-12(2)17-11-14(6-7-14)10-15-8-4-5-13(15)9-16-3/h12-13H,4-11H2,1-3H3
InChIKeyCIUXUUUKDRIVED-UHFFFAOYSA-N
XLogP2.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-methoxy-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 170926000
(2R)-1-ethyl-2-(methoxymethyl)pyrrolidine
CID 59678139
2-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-2-azabicyclo[2.2.2]octane
CID 174179731
(3S,4R)-4-fluoro-3-methoxy-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 170926336
(3S)-N,N-dimethyl-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidin-3-amine
CID 170926263
(2S)-1-(cyclopropylmethyl)-2-(methoxymethyl)pyrrolidine
CID 142484052
4-fluoro-1-[[1-(propan-2-yloxymethyl)cyclobutyl]methyl]piperidine
CID 177010231
(3S)-3-methyl-4-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]morpholine
CID 170926284
(2R)-2-(methoxymethyl)-1-(methylsulfanylmethyl)pyrrolidine
CID 134386635
(2R)-1-(2,2-difluoroethyl)-2-(methoxymethyl)pyrrolidine;propane
CID 145338634
ethane;propan-2-yl (2S)-2-(methoxymethyl)pyrrolidine-1-carboxylate
CID 143059682
4-tert-butyl-3,3-difluoro-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]azepane
CID 169289987

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine?
The IUPAC name of 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine (CID 176926874) is 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine.
What is the SMILES notation for 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine?
The canonical SMILES for 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine is COCC1CCCN1CC1(COC(C)C)CC1.
What is the InChIKey of 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine?
The InChIKey is CIUXUUUKDRIVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12(2)17-11-14(6-7-14)10-15-8-4-5-13(15)9-16-3/h12-13H,4-11H2,1-3H3.
What are the key properties of 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine?
2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine has a molecular weight of 241.37 g/mol, XLogP of 2.30, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine is sourced from PubChem (CID 176926874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).