1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one

C16H27N3O — CID 114507542

IUPAC1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one
SMILESCCNC1CCN(CCn2ccccc2=O)CC1CC
InChIInChI=1S/C16H27N3O/c1-3-14-13-18(10-8-15(14)17-4-2)11-12-19-9-6-5-7-16(19)20/h5-7,9,14-15,17H,3-4,8,10-13H2,1-2H3
InChIKeyIQEACDNXVUADDG-UHFFFAOYSA-N
MW277.41 g/mol
LogP1.56
Rot. Bonds6

About 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one

1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one (PubChem CID 114507542) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one
PubChem CID114507542
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one
SMILESCCNC1CCN(CCn2ccccc2=O)CC1CC
InChIInChI=1S/C16H27N3O/c1-3-14-13-18(10-8-15(14)17-4-2)11-12-19-9-6-5-7-16(19)20/h5-7,9,14-15,17H,3-4,8,10-13H2,1-2H3
InChIKeyIQEACDNXVUADDG-UHFFFAOYSA-N
XLogP1.56
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one
CID 82907183
N,3-diethyl-1-(2-methylsulfonylethyl)piperidin-4-amine
CID 114507432
1-[2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]ethyl]pyridin-2-one
CID 82897001
1-[2-(4-chloropiperidin-1-yl)ethyl]pyridin-2-one
CID 82907199
1-[2-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]pyridin-2-one
CID 115714054
1-(2-tert-butylsulfonylethyl)-N,3-diethylpiperidin-4-amine
CID 106721540
[4-[[3-ethyl-4-(ethylamino)piperidin-1-yl]methyl]phenyl]methanol
CID 114507523
1-[2-[3-[1-(methylamino)ethyl]piperidin-1-yl]ethyl]pyridin-2-one
CID 82896584
1-[2-(3-amino-4-methylpyrrolidin-1-yl)ethyl]pyridin-2-one
CID 103576927
1-[2-[3-(aminomethyl)piperidin-1-yl]ethyl]pyridin-2-one
CID 82897538
N,3-diethyl-1-(2-fluorophenyl)sulfonylpiperidin-4-amine
CID 114507138
1-[2-[3-(propylaminomethyl)piperidin-1-yl]ethyl]pyridin-2-one
CID 82896565

Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one?
The IUPAC name of 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one (CID 114507542) is 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one is CCNC1CCN(CCn2ccccc2=O)CC1CC.
What is the InChIKey of 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one?
The InChIKey is IQEACDNXVUADDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-3-14-13-18(10-8-15(14)17-4-2)11-12-19-9-6-5-7-16(19)20/h5-7,9,14-15,17H,3-4,8,10-13H2,1-2H3.
What are the key properties of 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one?
1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one has a molecular weight of 277.41 g/mol, XLogP of 1.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethyl]pyridin-2-one is sourced from PubChem (CID 114507542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).