2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone

C15H22N2O2 — CID 116559903

IUPAC2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone
SMILESCC(C)Oc1cncc(C(=O)CC2CCNCC2)c1
InChIInChI=1S/C15H22N2O2/c1-11(2)19-14-8-13(9-17-10-14)15(18)7-12-3-5-16-6-4-12/h8-12,16H,3-7H2,1-2H3
InChIKeyRWQBULMHAVDWIG-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.44
Rot. Bonds5

About 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone

2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone (PubChem CID 116559903) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone.

Molecular Properties

Compound Name2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone
PubChem CID116559903
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone
SMILESCC(C)Oc1cncc(C(=O)CC2CCNCC2)c1
InChIInChI=1S/C15H22N2O2/c1-11(2)19-14-8-13(9-17-10-14)15(18)7-12-3-5-16-6-4-12/h8-12,16H,3-7H2,1-2H3
InChIKeyRWQBULMHAVDWIG-UHFFFAOYSA-N
XLogP2.44
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-propan-2-yloxy-3-pyridinyl)-2-pyrrolidin-2-ylethanone
CID 116560870
2-cycloheptyl-1-(5-methoxy-3-pyridinyl)ethanone
CID 115793367
3-(ethylamino)-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)propan-1-one
CID 116565258
7-amino-1-(5-propan-2-yloxy-3-pyridinyl)heptan-1-one
CID 116551477
(2-methylcyclopentyl)-(5-propan-2-yloxy-3-pyridinyl)methanone
CID 107187372
(2S,5S)-5-methyl-1-(5-propan-2-yloxypyridine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 154865526
1-(5-propan-2-yloxy-3-pyridinyl)prop-2-en-1-one
CID 103453607
(5-propan-2-yloxy-3-pyridinyl)-(3-propylpiperidin-3-yl)methanone
CID 116569701
4-amino-2-methyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-one
CID 116594885
1-(5-propan-2-yloxy-3-pyridinyl)-2-propylpentan-1-one
CID 115794638
2-amino-2-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-one
CID 116592678
(4R)-4-hydroxy-1-(5-propan-2-yloxy-3-pyridinyl)-4-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]butan-1-one;dihydrochloride
CID 160722144

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone?
The IUPAC name of 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone (CID 116559903) is 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone.
What is the SMILES notation for 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone?
The canonical SMILES for 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone is CC(C)Oc1cncc(C(=O)CC2CCNCC2)c1.
What is the InChIKey of 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone?
The InChIKey is RWQBULMHAVDWIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(2)19-14-8-13(9-17-10-14)15(18)7-12-3-5-16-6-4-12/h8-12,16H,3-7H2,1-2H3.
What are the key properties of 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone?
2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone has a molecular weight of 262.35 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-1-(5-propan-2-yloxy-3-pyridinyl)ethanone is sourced from PubChem (CID 116559903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).