[3-(2-methoxyethyl)pyrrolidin-3-yl]methanol

C8H17NO2 — CID 66059642

IUPAC[3-(2-methoxyethyl)pyrrolidin-3-yl]methanol
SMILESCOCCC1(CO)CCNC1
InChIInChI=1S/C8H17NO2/c1-11-5-3-8(7-10)2-4-9-6-8/h9-10H,2-7H2,1H3
InChIKeyKBUKTZHAESULHH-UHFFFAOYSA-N
MW159.23 g/mol
LogP-0.01
Rot. Bonds4

About [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol

[3-(2-methoxyethyl)pyrrolidin-3-yl]methanol (PubChem CID 66059642) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(2-methoxyethyl)pyrrolidin-3-yl]methanol
PubChem CID66059642
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name[3-(2-methoxyethyl)pyrrolidin-3-yl]methanol
SMILESCOCCC1(CO)CCNC1
InChIInChI=1S/C8H17NO2/c1-11-5-3-8(7-10)2-4-9-6-8/h9-10H,2-7H2,1H3
InChIKeyKBUKTZHAESULHH-UHFFFAOYSA-N
XLogP-0.01
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol?
The IUPAC name of [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol (CID 66059642) is [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol is COCCC1(CO)CCNC1.
What is the InChIKey of [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol?
The InChIKey is KBUKTZHAESULHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-11-5-3-8(7-10)2-4-9-6-8/h9-10H,2-7H2,1H3.
What are the key properties of [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol?
[3-(2-methoxyethyl)pyrrolidin-3-yl]methanol has a molecular weight of 159.23 g/mol, XLogP of -0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyethyl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 66059642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).