ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine

C13H27NO — CID 168995558

IUPACethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine
SMILESCC.COCC1(CN2CCCC2C)CC1
InChIInChI=1S/C11H21NO.C2H6/c1-10-4-3-7-12(10)8-11(5-6-11)9-13-2;1-2/h10H,3-9H2,1-2H3;1-2H3
InChIKeyHCGSKNUKQMGQKZ-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.92
Rot. Bonds4

About ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine

ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine (PubChem CID 168995558) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine.

Molecular Properties

Compound Nameethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine
PubChem CID168995558
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Nameethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine
SMILESCC.COCC1(CN2CCCC2C)CC1
InChIInChI=1S/C11H21NO.C2H6/c1-10-4-3-7-12(10)8-11(5-6-11)9-13-2;1-2/h10H,3-9H2,1-2H3;1-2H3
InChIKeyHCGSKNUKQMGQKZ-UHFFFAOYSA-N
XLogP2.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 164878349
(3R)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 167190956
(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 167254755
(2S)-1-(3-methoxypropyl)-2-methylpyrrolidine
CID 67965890
(2R)-1-(3-methoxypropyl)-2-methylpyrrolidine
CID 67965896
(1-((2-Methylpyrrolidin-1-yl)methyl)cyclopropyl)methanol
CID 104550691
5-(3-Methoxypropyl)-5-azaspiro[2.4]heptane
CID 129270201
1-Cyclopropyl-3-(methoxymethyl)pyrrolidine
CID 132021117
3-Ethyl-3-(methoxymethyl)-1-propan-2-ylpyrrolidine
CID 134242781
7-Hexan-2-yl-2-oxa-7-azaspiro[3.4]octane
CID 138625328
1-[[1-(Methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 142524145
(2S,3S)-3-(methoxymethyl)-1,2-dimethylpyrrolidine
CID 143529669

Frequently Asked Questions

What is the IUPAC name of ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
The IUPAC name of ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine (CID 168995558) is ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine.
What is the SMILES notation for ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
The canonical SMILES for ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine is CC.COCC1(CN2CCCC2C)CC1.
What is the InChIKey of ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
The InChIKey is HCGSKNUKQMGQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO.C2H6/c1-10-4-3-7-12(10)8-11(5-6-11)9-13-2;1-2/h10H,3-9H2,1-2H3;1-2H3.
What are the key properties of ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine has a molecular weight of 213.36 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine is sourced from PubChem (CID 168995558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).