1-ethenylpyrrolidine;2H-pyran

C11H17NO — CID 174424402

IUPAC1-ethenylpyrrolidine;2H-pyran
SMILESC1=CCOC=C1.C=CN1CCCC1
InChIInChI=1S/C6H11N.C5H6O/c1-2-7-5-3-4-6-7;1-2-4-6-5-3-1/h2H,1,3-6H2;1-4H,5H2
InChIKeySWLMWIDOMCSREB-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.31
Rot. Bonds1

About 1-ethenylpyrrolidine;2H-pyran

1-ethenylpyrrolidine;2H-pyran (PubChem CID 174424402) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 1-ethenylpyrrolidine;2H-pyran.

Molecular Properties

Compound Name1-ethenylpyrrolidine;2H-pyran
PubChem CID174424402
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name1-ethenylpyrrolidine;2H-pyran
SMILESC1=CCOC=C1.C=CN1CCCC1
InChIInChI=1S/C6H11N.C5H6O/c1-2-7-5-3-4-6-7;1-2-4-6-5-3-1/h2H,1,3-6H2;1-4H,5H2
InChIKeySWLMWIDOMCSREB-UHFFFAOYSA-N
XLogP2.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-Di-n-propylaminopyran
CID 129807214
1-(2H-pyran-5-yl)pyrrolidine
CID 22907890
1-(2H-pyran-2-yl)-2,3-dihydropyrrole
CID 69621149
1-(2H-pyran-2-yl)pyrrolidine
CID 89560377
(2R)-1-methyl-2-(pyrrolidin-1-ylmethoxy)-2H-pyridine
CID 152749458
(2S)-1-methyl-2-(pyrrolidin-1-ylmethoxy)-2H-pyridine
CID 152749459
butyl(triethyl)azanium;2H-pyran
CID 158370510
1-(2H-pyran-3-yl)pyrrolidine
CID 173327826

Frequently Asked Questions

What is the IUPAC name of 1-ethenylpyrrolidine;2H-pyran?
The IUPAC name of 1-ethenylpyrrolidine;2H-pyran (CID 174424402) is 1-ethenylpyrrolidine;2H-pyran.
What is the SMILES notation for 1-ethenylpyrrolidine;2H-pyran?
The canonical SMILES for 1-ethenylpyrrolidine;2H-pyran is C1=CCOC=C1.C=CN1CCCC1.
What is the InChIKey of 1-ethenylpyrrolidine;2H-pyran?
The InChIKey is SWLMWIDOMCSREB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.C5H6O/c1-2-7-5-3-4-6-7;1-2-4-6-5-3-1/h2H,1,3-6H2;1-4H,5H2.
What are the key properties of 1-ethenylpyrrolidine;2H-pyran?
1-ethenylpyrrolidine;2H-pyran has a molecular weight of 179.26 g/mol, XLogP of 2.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylpyrrolidine;2H-pyran is sourced from PubChem (CID 174424402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).