(2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone

C15H23N3O — CID 105070518

IUPAC(2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone
SMILESCCNc1cnccc1C(=O)N1CC(C)CCC1C
InChIInChI=1S/C15H23N3O/c1-4-17-14-9-16-8-7-13(14)15(19)18-10-11(2)5-6-12(18)3/h7-9,11-12,17H,4-6,10H2,1-3H3
InChIKeyRQQNDBBMVUKJAG-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.77
Rot. Bonds3

About (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone

(2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone (PubChem CID 105070518) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone.

Molecular Properties

Compound Name(2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone
PubChem CID105070518
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name(2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone
SMILESCCNc1cnccc1C(=O)N1CC(C)CCC1C
InChIInChI=1S/C15H23N3O/c1-4-17-14-9-16-8-7-13(14)15(19)18-10-11(2)5-6-12(18)3/h7-9,11-12,17H,4-6,10H2,1-3H3
InChIKeyRQQNDBBMVUKJAG-UHFFFAOYSA-N
XLogP2.77
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(ethylamino)-4-pyridinyl]-(2-propylpiperidin-1-yl)methanone
CID 105071000
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-[3-(ethylamino)-4-pyridinyl]methanone
CID 105071465
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-[3-(ethylamino)-4-pyridinyl]methanone
CID 105070449
[4-(ethylamino)-3-pyridinyl]-(2-methylpyrrolidin-1-yl)methanone
CID 81234090
N-(2,4-dimethylcyclohexyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105070253
[3-(ethylamino)-4-pyridinyl]-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 105070176
[3-(ethylamino)-4-pyridinyl]-(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)methanone
CID 105071079
[3-(ethylamino)-4-pyridinyl]-(4-methoxypiperidin-1-yl)methanone
CID 105068580
[4-(ethylamino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 81236620
[3-(ethylamino)-4-pyridinyl]-(2-methyl-1,4-oxazepan-4-yl)methanone
CID 105069932
(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
CID 81236942
(3,5-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
CID 81236821

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone?
The IUPAC name of (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone (CID 105070518) is (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone.
What is the SMILES notation for (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone?
The canonical SMILES for (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone is CCNc1cnccc1C(=O)N1CC(C)CCC1C.
What is the InChIKey of (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone?
The InChIKey is RQQNDBBMVUKJAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-4-17-14-9-16-8-7-13(14)15(19)18-10-11(2)5-6-12(18)3/h7-9,11-12,17H,4-6,10H2,1-3H3.
What are the key properties of (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone?
(2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone has a molecular weight of 261.37 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylpiperidin-1-yl)-[3-(ethylamino)-4-pyridinyl]methanone is sourced from PubChem (CID 105070518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).