(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine

C8H17NO — CID 178147098

IUPAC(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine
SMILESCC[C@@H]1C[C@@H](COC)CN1
InChIInChI=1S/C8H17NO/c1-3-8-4-7(5-9-8)6-10-2/h7-9H,3-6H2,1-2H3/t7-,8-/m1/s1
InChIKeyBIRPQGNIIJFWQH-HTQZYQBOSA-N
MW143.23 g/mol
LogP1.02
Rot. Bonds3

About (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine

(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine (PubChem CID 178147098) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine.

Molecular Properties

Compound Name(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine
PubChem CID178147098
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine
SMILESCC[C@@H]1C[C@@H](COC)CN1
InChIInChI=1S/C8H17NO/c1-3-8-4-7(5-9-8)6-10-2/h7-9H,3-6H2,1-2H3/t7-,8-/m1/s1
InChIKeyBIRPQGNIIJFWQH-HTQZYQBOSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4S)-2-ethyl-4-(2-methoxyethoxy)pyrrolidine
CID 99994845
(2S,4S)-4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 119057051
4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 122236424
(2S,4R)-2-(methoxymethyl)-4-[(2-methylpropan-2-yl)oxy]pyrrolidine
CID 57326561
(3S,5R)-5-(methoxymethyl)pyrrolidin-3-ol;hydrochloride
CID 155904303
2-[(2S,4R)-4-ethylpyrrolidin-2-yl]ethanamine
CID 124676173
(2S,4R)-2-ethyl-4-propoxypyrrolidine
CID 99994381
ethane;5-(methoxymethyl)pyrrolidin-3-ol
CID 162382010
2-fluoro-3-[[(2S)-4-(methoxymethyl)pyrrolidin-2-yl]methoxy]-4-methylpyridine
CID 146510575
(2R)-4-tert-butyl-2-ethylpyrrolidine
CID 122428440
2-ethyl-4-propan-2-ylpyrrolidine
CID 55288248
5-(methoxymethyl)-1,3-diazinane
CID 90715874

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine?
The IUPAC name of (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine (CID 178147098) is (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine.
What is the SMILES notation for (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine?
The canonical SMILES for (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine is CC[C@@H]1C[C@@H](COC)CN1.
What is the InChIKey of (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine?
The InChIKey is BIRPQGNIIJFWQH-HTQZYQBOSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-8-4-7(5-9-8)6-10-2/h7-9H,3-6H2,1-2H3/t7-,8-/m1/s1.
What are the key properties of (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine?
(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine has a molecular weight of 143.23 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine is sourced from PubChem (CID 178147098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).