(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone

C12H14N2O2 — CID 155919849

IUPAC(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone
SMILESC=Cc1cncc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C12H14N2O2/c1-2-10-7-11(9-13-8-10)12(15)14-3-5-16-6-4-14/h2,7-9H,1,3-6H2
InChIKeyFQKTXNIUKFCHOB-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.20
Rot. Bonds2

About (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone

(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone (PubChem CID 155919849) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone
PubChem CID155919849
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone
SMILESC=Cc1cncc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C12H14N2O2/c1-2-10-7-11(9-13-8-10)12(15)14-3-5-16-6-4-14/h2,7-9H,1,3-6H2
InChIKeyFQKTXNIUKFCHOB-UHFFFAOYSA-N
XLogP1.20
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone?
The IUPAC name of (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone (CID 155919849) is (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone is C=Cc1cncc(C(=O)N2CCOCC2)c1.
What is the InChIKey of (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone?
The InChIKey is FQKTXNIUKFCHOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-2-10-7-11(9-13-8-10)12(15)14-3-5-16-6-4-14/h2,7-9H,1,3-6H2.
What are the key properties of (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone?
(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone has a molecular weight of 218.26 g/mol, XLogP of 1.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 155919849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).