1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride

C10H14ClNO3 — CID 71645185

IUPAC1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride
SMILESCl.O=C(COC1CCNC1)c1ccco1
InChIInChI=1S/C10H13NO3.ClH/c12-9(10-2-1-5-13-10)7-14-8-3-4-11-6-8;/h1-2,5,8,11H,3-4,6-7H2;1H
InChIKeyGWQDJPAMQDWNDW-UHFFFAOYSA-N
MW231.68 g/mol
LogP1.26
Rot. Bonds4

About 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride

1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride (PubChem CID 71645185) has the molecular formula C10H14ClNO3 and a molecular weight of 231.68 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride.

Molecular Properties

Compound Name1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride
PubChem CID71645185
Molecular FormulaC10H14ClNO3
Molecular Weight231.68 g/mol
Exact Mass231.07
IUPAC Name1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride
SMILESCl.O=C(COC1CCNC1)c1ccco1
InChIInChI=1S/C10H13NO3.ClH/c12-9(10-2-1-5-13-10)7-14-8-3-4-11-6-8;/h1-2,5,8,11H,3-4,6-7H2;1H
InChIKeyGWQDJPAMQDWNDW-UHFFFAOYSA-N
XLogP1.26
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.68
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-2-(3-methylcyclohexyl)oxyethanone
CID 43800878
1-(furan-2-yl)-2-[[(3S)-pyrrolidin-3-yl]methylamino]ethanone
CID 97165702
N-(2-piperidin-4-yloxyethyl)furan-2-carboxamide
CID 55251726
2-[(3S)-pyrrolidin-3-yl]oxyacetamide
CID 94401198
1-pyrazin-2-yl-2-[(3R)-pyrrolidin-3-yl]oxyethanone;hydrochloride
CID 71645143
1-pyrazin-2-yl-2-pyrrolidin-3-yloxyethanone;hydrochloride
CID 71645191
tert-butyl (3S)-3-[2-(furan-2-yl)-2-oxoethoxy]pyrrolidine-1-carboxylate
CID 71629342
piperidin-4-ylmethyl furan-2-carboxylate
CID 53410145
3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride
CID 66987447
1-(furan-2-yl)-2-(2-methylpropoxy)ethanone
CID 43798717
2-[(3S)-piperidin-3-yl]oxy-1-pyridin-2-ylethanone
CID 71645154
methyl 2-[(3S)-pyrrolidin-3-yl]oxyacetate
CID 34180571

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride?
The IUPAC name of 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride (CID 71645185) is 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride.
What is the SMILES notation for 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride?
The canonical SMILES for 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride is Cl.O=C(COC1CCNC1)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride?
The InChIKey is GWQDJPAMQDWNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3.ClH/c12-9(10-2-1-5-13-10)7-14-8-3-4-11-6-8;/h1-2,5,8,11H,3-4,6-7H2;1H.
What are the key properties of 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride?
1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride has a molecular weight of 231.68 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-pyrrolidin-3-yloxyethanone;hydrochloride is sourced from PubChem (CID 71645185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).