ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one

C11H20N2O — CID 171650083

IUPACethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one
SMILESC=CC1=C(NC)C(=O)N(C)CC1.CC
InChIInChI=1S/C9H14N2O.C2H6/c1-4-7-5-6-11(3)9(12)8(7)10-2;1-2/h4,10H,1,5-6H2,2-3H3;1-2H3
InChIKeyVYGQCDZZFNFTEL-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.53
Rot. Bonds2

About ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one

ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one (PubChem CID 171650083) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one.

Molecular Properties

Compound Nameethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one
PubChem CID171650083
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Nameethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one
SMILESC=CC1=C(NC)C(=O)N(C)CC1.CC
InChIInChI=1S/C9H14N2O.C2H6/c1-4-7-5-6-11(3)9(12)8(7)10-2;1-2/h4,10H,1,5-6H2,2-3H3;1-2H3
InChIKeyVYGQCDZZFNFTEL-UHFFFAOYSA-N
XLogP1.53
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one?
The IUPAC name of ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one (CID 171650083) is ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one.
What is the SMILES notation for ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one?
The canonical SMILES for ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one is C=CC1=C(NC)C(=O)N(C)CC1.CC.
What is the InChIKey of ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one?
The InChIKey is VYGQCDZZFNFTEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O.C2H6/c1-4-7-5-6-11(3)9(12)8(7)10-2;1-2/h4,10H,1,5-6H2,2-3H3;1-2H3.
What are the key properties of ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one?
ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one has a molecular weight of 196.29 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethenyl-1-methyl-5-(methylamino)-2,3-dihydropyridin-6-one is sourced from PubChem (CID 171650083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).