ethane;3-ethoxypyrrolidine

C8H19NO — CID 142624915

IUPACethane;3-ethoxypyrrolidine
SMILESCC.CCOC1CCNC1
InChIInChI=1S/C6H13NO.C2H6/c1-2-8-6-3-4-7-5-6;1-2/h6-7H,2-5H2,1H3;1-2H3
InChIKeyFQOXQKBOJWDXEF-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.41
Rot. Bonds2

About ethane;3-ethoxypyrrolidine

ethane;3-ethoxypyrrolidine (PubChem CID 142624915) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is ethane;3-ethoxypyrrolidine.

Molecular Properties

Compound Nameethane;3-ethoxypyrrolidine
PubChem CID142624915
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Nameethane;3-ethoxypyrrolidine
SMILESCC.CCOC1CCNC1
InChIInChI=1S/C6H13NO.C2H6/c1-2-8-6-3-4-7-5-6;1-2/h6-7H,2-5H2,1H3;1-2H3
InChIKeyFQOXQKBOJWDXEF-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethoxypyrrolidine
CID 21333172
(3S)-3-ethoxypyrrolidine
CID 11116030
2,2-dimethylpropanoic acid;(3R)-3-ethoxypyrrolidine
CID 174626759
(3R)-3-propoxypyrrolidine;hydrochloride
CID 138393556
3-ethoxyazetidine
CID 22507733
3-(2-methoxyethoxy)pyrrolidine
CID 18337162
(3R)-3-(2-propoxyethoxy)pyrrolidine
CID 86322695
N,N-diethyl-2-pyrrolidin-3-yloxyacetamide
CID 62327394
N-ethyl-N-methyl-2-pyrrolidin-3-yloxyacetamide
CID 62327910
(3S)-3-prop-2-enoxypyrrolidine
CID 26191822
(3R)-3-(4-methylpentoxy)pyrrolidine
CID 115460364
triethyl-[(3S)-pyrrolidin-3-yl]oxysilane
CID 175987275

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethoxypyrrolidine?
The IUPAC name of ethane;3-ethoxypyrrolidine (CID 142624915) is ethane;3-ethoxypyrrolidine.
What is the SMILES notation for ethane;3-ethoxypyrrolidine?
The canonical SMILES for ethane;3-ethoxypyrrolidine is CC.CCOC1CCNC1.
What is the InChIKey of ethane;3-ethoxypyrrolidine?
The InChIKey is FQOXQKBOJWDXEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.C2H6/c1-2-8-6-3-4-7-5-6;1-2/h6-7H,2-5H2,1H3;1-2H3.
What are the key properties of ethane;3-ethoxypyrrolidine?
ethane;3-ethoxypyrrolidine has a molecular weight of 145.25 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethoxypyrrolidine is sourced from PubChem (CID 142624915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).