2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol

C12H23NO2 — CID 103137712

IUPAC2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol
SMILESCC1CCC(CN2CCC(CCO)C2)O1
InChIInChI=1S/C12H23NO2/c1-10-2-3-12(15-10)9-13-6-4-11(8-13)5-7-14/h10-12,14H,2-9H2,1H3
InChIKeyMJMQKVVWWQLUDG-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.26
Rot. Bonds4

About 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol

2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol (PubChem CID 103137712) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol
PubChem CID103137712
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol
SMILESCC1CCC(CN2CCC(CCO)C2)O1
InChIInChI=1S/C12H23NO2/c1-10-2-3-12(15-10)9-13-6-4-11(8-13)5-7-14/h10-12,14H,2-9H2,1H3
InChIKeyMJMQKVVWWQLUDG-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]propanoic acid
CID 82838620
4-(bromomethyl)-1-[(5-methyloxolan-2-yl)methyl]piperidine
CID 103139885
1-[(5-methyloxolan-2-yl)methyl]piperidine-3,4-dicarboxylic acid
CID 103136020
4-bromo-3-methyl-1-[(5-methyloxolan-2-yl)methyl]piperidine
CID 103140046
(3S)-1-[(5-methyloxolan-2-yl)methyl]piperidin-3-ol
CID 107225929
(3R,4S)-1-[(5-methyloxolan-2-yl)methyl]pyrrolidine-3,4-diol
CID 103137660
5-[[3-(2-hydroxyethyl)piperidin-1-yl]methyl]oxolane-2-carboxylic acid
CID 107227845
2-[1-(piperidin-4-ylmethyl)pyrrolidin-3-yl]ethanol
CID 115741583
2-[1-(2-methylpropyl)pyrrolidin-3-yl]ethanol
CID 83981105
4-methyl-1-[(5-methyloxolan-2-yl)methyl]piperidin-4-ol
CID 103137665
2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
CID 114800248
2-[1-[(4-methylmorpholin-2-yl)methyl]piperidin-3-yl]ethanol
CID 112734129

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol?
The IUPAC name of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol (CID 103137712) is 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol?
The canonical SMILES for 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol is CC1CCC(CN2CCC(CCO)C2)O1.
What is the InChIKey of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol?
The InChIKey is MJMQKVVWWQLUDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10-2-3-12(15-10)9-13-6-4-11(8-13)5-7-14/h10-12,14H,2-9H2,1H3.
What are the key properties of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol?
2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol has a molecular weight of 213.32 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 103137712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).