4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one

C13H19N3O3 — CID 81457773

IUPAC4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one
SMILESCCC1CN(C(=O)c2cc(O)[nH]c(=O)c2)CCC1N
InChIInChI=1S/C13H19N3O3/c1-2-8-7-16(4-3-10(8)14)13(19)9-5-11(17)15-12(18)6-9/h5-6,8,10H,2-4,7,14H2,1H3,(H2,15,17,18)
InChIKeyNBOBEJBWTIJCDK-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.28
Rot. Bonds2

About 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one

4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one (PubChem CID 81457773) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one
PubChem CID81457773
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one
SMILESCCC1CN(C(=O)c2cc(O)[nH]c(=O)c2)CCC1N
InChIInChI=1S/C13H19N3O3/c1-2-8-7-16(4-3-10(8)14)13(19)9-5-11(17)15-12(18)6-9/h5-6,8,10H,2-4,7,14H2,1H3,(H2,15,17,18)
InChIKeyNBOBEJBWTIJCDK-UHFFFAOYSA-N
XLogP0.28
TPSA99.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 66260859
6-hydroxy-4-[3-(2-hydroxyethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 114799248
ethyl (3R)-1-(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)piperidine-3-carboxylate
CID 115538799
(4-amino-3-ethylpiperidin-1-yl)-(5-methyl-3-pyridinyl)methanone
CID 81458199
6-hydroxy-4-(piperazine-1-carbonyl)-1H-pyridin-2-one
CID 24699091
(4-amino-3-ethylpiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 81457893
(4-amino-3-ethylpiperidin-1-yl)-(1H-pyrrol-2-yl)methanone
CID 81457630
(4-amino-3-ethylpiperidin-1-yl)-(2-chloro-5-hydroxyphenyl)methanone
CID 106499980
4-[3-(4-cyclohexylpiperazin-1-yl)azetidine-1-carbonyl]-6-hydroxy-1H-pyridin-2-one
CID 126892532
4-[3-(4-fluorophenyl)azepane-1-carbonyl]-6-hydroxy-1H-pyridin-2-one
CID 121146340
4-[2-(aminomethyl)-4-methylpiperidine-1-carbonyl]-6-hydroxy-1H-pyridin-2-one
CID 103440801
4-amino-3-ethylpiperidine-1-carboxylic acid
CID 90001260

Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one?
The IUPAC name of 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one (CID 81457773) is 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one.
What is the SMILES notation for 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one?
The canonical SMILES for 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one is CCC1CN(C(=O)c2cc(O)[nH]c(=O)c2)CCC1N.
What is the InChIKey of 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one?
The InChIKey is NBOBEJBWTIJCDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-2-8-7-16(4-3-10(8)14)13(19)9-5-11(17)15-12(18)6-9/h5-6,8,10H,2-4,7,14H2,1H3,(H2,15,17,18).
What are the key properties of 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one?
4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one has a molecular weight of 265.31 g/mol, XLogP of 0.28, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one is sourced from PubChem (CID 81457773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).