2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine

C8H14N2O — CID 174864326

IUPAC2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine
SMILESC(=C1NCCO1)N1CCCC1
InChIInChI=1S/C8H14N2O/c1-2-5-10(4-1)7-8-9-3-6-11-8/h7,9H,1-6H2
InChIKeySLCXJXDYFQIMLU-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.50
Rot. Bonds1

About 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine

2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine (PubChem CID 174864326) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine.

Molecular Properties

Compound Name2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine
PubChem CID174864326
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine
SMILESC(=C1NCCO1)N1CCCC1
InChIInChI=1S/C8H14N2O/c1-2-5-10(4-1)7-8-9-3-6-11-8/h7,9H,1-6H2
InChIKeySLCXJXDYFQIMLU-UHFFFAOYSA-N
XLogP0.50
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2E)-2-benzylidene-1,3-oxazolidine
CID 102070685
2-(2-methylpropylidene)-1,3-oxazolidine
CID 174399163
2-(1,3-oxazinan-2-ylidene)acetic acid
CID 67780353
2-pentylidene-1,3-oxazolidine
CID 174633347
5-(piperidin-1-ylmethylidene)-1,3-diazinane-2,4,6-trione
CID 21234974
1,3-oxazolidin-2-one;hydrate
CID 141149411
1,3-oxazolidin-2-one;stannane
CID 173239925
2-(1,3-thiazol-2-yloxymethylidene)-1,3-oxazolidine
CID 70627569
1-ethenylpyrrolidine;pyrrolidin-2-one
CID 174946746
3-(piperidin-1-ylmethylidene)pyrrolidine-2,4-dione
CID 3428337
1-(cyclooctylidenemethyl)pyrrolidine
CID 12584847
1-methyl-4-[(E)-oxolan-2-ylidenemethyl]piperazine
CID 23271502

Frequently Asked Questions

What is the IUPAC name of 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine?
The IUPAC name of 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine (CID 174864326) is 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine.
What is the SMILES notation for 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine?
The canonical SMILES for 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine is C(=C1NCCO1)N1CCCC1.
What is the InChIKey of 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine?
The InChIKey is SLCXJXDYFQIMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-5-10(4-1)7-8-9-3-6-11-8/h7,9H,1-6H2.
What are the key properties of 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine?
2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine has a molecular weight of 154.21 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine is sourced from PubChem (CID 174864326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).