(4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone

C14H20N2O2 — CID 55139224

IUPAC(4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone
SMILESCCC1(C)CCN(C(=O)c2ncccc2O)CC1
InChIInChI=1S/C14H20N2O2/c1-3-14(2)6-9-16(10-7-14)13(18)12-11(17)5-4-8-15-12/h4-5,8,17H,3,6-7,9-10H2,1-2H3
InChIKeyMLMDSRJEMNJLAM-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.44
Rot. Bonds2

About (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone

(4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone (PubChem CID 55139224) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone.

Molecular Properties

Compound Name(4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone
PubChem CID55139224
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name(4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone
SMILESCCC1(C)CCN(C(=O)c2ncccc2O)CC1
InChIInChI=1S/C14H20N2O2/c1-3-14(2)6-9-16(10-7-14)13(18)12-11(17)5-4-8-15-12/h4-5,8,17H,3,6-7,9-10H2,1-2H3
InChIKeyMLMDSRJEMNJLAM-UHFFFAOYSA-N
XLogP2.44
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(7,7-dimethyl-1,4-thiazepan-4-yl)-(3-hydroxy-2-pyridinyl)methanone
CID 107300789
azocan-1-yl-(3-hydroxy-2-pyridinyl)methanone
CID 54861395
[2-(ethylamino)-3-pyridinyl]-(4-ethyl-4-methylpiperidin-1-yl)methanone
CID 63162177
3-ethyl-1-(3-hydroxypyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 63134123
(3-hydroxy-2-pyridinyl)-(4-propylpiperidin-1-yl)methanone
CID 62205969
1-(3-bromopyridine-2-carbonyl)-4-ethylpiperidine-4-carboxylic acid
CID 107517094
[(4R)-2-ethyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 97155661
[(3S,4R)-3-hydroxy-4-(hydroxymethyl)-4-propylpiperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 155915724
(3-hydroxy-2-pyridinyl)-thiomorpholin-4-ylmethanone
CID 60923480
(3S)-8-(3-hydroxypyridine-2-carbonyl)-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 95880584
[4-(1-hydroxyethyl)piperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 104954674
[4-(ethylaminomethyl)piperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 80552354

Frequently Asked Questions

What is the IUPAC name of (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone?
The IUPAC name of (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone (CID 55139224) is (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone.
What is the SMILES notation for (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone?
The canonical SMILES for (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone is CCC1(C)CCN(C(=O)c2ncccc2O)CC1.
What is the InChIKey of (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone?
The InChIKey is MLMDSRJEMNJLAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-14(2)6-9-16(10-7-14)13(18)12-11(17)5-4-8-15-12/h4-5,8,17H,3,6-7,9-10H2,1-2H3.
What are the key properties of (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone?
(4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone has a molecular weight of 248.33 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-4-methylpiperidin-1-yl)-(3-hydroxy-2-pyridinyl)methanone is sourced from PubChem (CID 55139224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).