6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one

C19H25NO — CID 11065955

IUPAC6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one
SMILESCC/C=C(\CC)C1=CCCC(=O)N1[C@H](C)c1ccccc1
InChIInChI=1S/C19H25NO/c1-4-10-16(5-2)18-13-9-14-19(21)20(18)15(3)17-11-7-6-8-12-17/h6-8,10-13,15H,4-5,9,14H2,1-3H3/b16-10+/t15-/m1/s1
InChIKeySRJFOMKXPYKEFE-VGVSSDJJSA-N
MW283.42 g/mol
LogP5.00
Rot. Bonds5

About 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one

6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one (PubChem CID 11065955) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one.

Molecular Properties

Compound Name6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one
PubChem CID11065955
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one
SMILESCC/C=C(\CC)C1=CCCC(=O)N1[C@H](C)c1ccccc1
InChIInChI=1S/C19H25NO/c1-4-10-16(5-2)18-13-9-14-19(21)20(18)15(3)17-11-7-6-8-12-17/h6-8,10-13,15H,4-5,9,14H2,1-3H3/b16-10+/t15-/m1/s1
InChIKeySRJFOMKXPYKEFE-VGVSSDJJSA-N
XLogP5.00
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.42
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-[(Z)-hex-1-enyl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one
CID 11076941
1-[(1R)-1-phenylethyl]-6-(2-phenylethynyl)-3,4-dihydropyridin-2-one
CID 11055737
(5Z)-5-ethylidene-1-[(1S)-1-phenylethyl]pyrrolidin-2-one
CID 15373975
3-[(1R)-1-phenylethyl]-2-sulfanylideneimidazolidin-4-one
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CID 154240876
3-(1-phenylethyl)-1,3-oxazolidine-2,4-dione
CID 3029673
2-[(1S)-1-phenylethyl]isoindole-1,3-dione
CID 792943
3,7-bis[(1R)-1-phenylethyl]-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetrone
CID 134961753
1-[(1S)-2-hydroxy-1-phenylethyl]pyrrolidine-2,5-dione
CID 71354940
6-(1-phenylethyl)-6-azatetracyclo[6.5.2.04,15.011,14]pentadeca-1(14),2,4(15),8,10-pentaene-5,7-dione
CID 2900583
1-(2-phenylpropyl)piperazine-2,5-dione
CID 113430277
(E,2S,3S)-2,4-dimethyl-3-phenylhept-4-enal
CID 102179027

Frequently Asked Questions

What is the IUPAC name of 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one?
The IUPAC name of 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one (CID 11065955) is 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one.
What is the SMILES notation for 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one?
The canonical SMILES for 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one is CC/C=C(\CC)C1=CCCC(=O)N1[C@H](C)c1ccccc1.
What is the InChIKey of 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one?
The InChIKey is SRJFOMKXPYKEFE-VGVSSDJJSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-10-16(5-2)18-13-9-14-19(21)20(18)15(3)17-11-7-6-8-12-17/h6-8,10-13,15H,4-5,9,14H2,1-3H3/b16-10+/t15-/m1/s1.
What are the key properties of 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one?
6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one has a molecular weight of 283.42 g/mol, XLogP of 5.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(E)-hex-3-en-3-yl]-1-[(1R)-1-phenylethyl]-3,4-dihydropyridin-2-one is sourced from PubChem (CID 11065955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).