(2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine

C11H21NO — CID 164878603

IUPAC(2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine
SMILESCOCC1(CN2CCC[C@@H]2C)CC1
InChIInChI=1S/C11H21NO/c1-10-4-3-7-12(10)8-11(5-6-11)9-13-2/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyVYUZOODCFLGRRN-JTQLQIEISA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds4

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

(2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine (PubChem CID 164878603) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine.

Molecular Properties

Compound Name(2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine
PubChem CID164878603
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine
SMILESCOCC1(CN2CCC[C@@H]2C)CC1
InChIInChI=1S/C11H21NO/c1-10-4-3-7-12(10)8-11(5-6-11)9-13-2/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyVYUZOODCFLGRRN-JTQLQIEISA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
The IUPAC name of (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine (CID 164878603) is (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine.
What is the SMILES notation for (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
The canonical SMILES for (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine is COCC1(CN2CCC[C@@H]2C)CC1.
What is the InChIKey of (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
The InChIKey is VYUZOODCFLGRRN-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21NO/c1-10-4-3-7-12(10)8-11(5-6-11)9-13-2/h10H,3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine?
(2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[[1-(methoxymethyl)cyclopropyl]methyl]-2-methylpyrrolidine is sourced from PubChem (CID 164878603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).