[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol

C7H15NO — CID 124705557

IUPAC[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol
SMILESCC[C@H]1NCC[C@H]1CO
InChIInChI=1S/C7H15NO/c1-2-7-6(5-9)3-4-8-7/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyPNLKUFNGOWFAIM-NKWVEPMBSA-N
MW129.20 g/mol
LogP0.37
Rot. Bonds2

About [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol

[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol (PubChem CID 124705557) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol
PubChem CID124705557
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol
SMILESCC[C@H]1NCC[C@H]1CO
InChIInChI=1S/C7H15NO/c1-2-7-6(5-9)3-4-8-7/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyPNLKUFNGOWFAIM-NKWVEPMBSA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-diethylpyrrolidine;molecular hydrogen
CID 178039705
(2R,3R)-2-ethylpyrrolidin-3-amine
CID 90066491
(2-ethylazetidin-3-yl)methanol
CID 105427056
ethane;1-(2-ethylpyrrolidin-3-yl)-N-methylmethanamine
CID 168902447
[(2S,3R)-3-methylpyrrolidin-2-yl]methanol
CID 66599997
3-(2-ethylpyrrolidin-3-yl)propanoic acid;hydrochloride
CID 174214436
(2S,3S)-2,3-diethylpiperidine
CID 89278402
2,3-diethylpiperidine;ethane
CID 144800386
2,3-diethylpiperidine;propane
CID 143653277
3-benzyl-2-ethylpyrrolidine
CID 4543797
(2S,3S)-2-ethylpyrrolidine-3-carboxylic acid
CID 95993864
[2-(phenoxymethyl)pyrrolidin-3-yl]methanol
CID 56975275

Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol?
The IUPAC name of [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol (CID 124705557) is [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol.
What is the SMILES notation for [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol?
The canonical SMILES for [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol is CC[C@H]1NCC[C@H]1CO.
What is the InChIKey of [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol?
The InChIKey is PNLKUFNGOWFAIM-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H15NO/c1-2-7-6(5-9)3-4-8-7/h6-9H,2-5H2,1H3/t6-,7+/m0/s1.
What are the key properties of [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol?
[(2R,3R)-2-ethylpyrrolidin-3-yl]methanol has a molecular weight of 129.20 g/mol, XLogP of 0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-2-ethylpyrrolidin-3-yl]methanol is sourced from PubChem (CID 124705557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).