1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone

C13H19N3O — CID 116560007

IUPAC1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone
SMILESCc1cnc(N)c(C(=O)CC2CCNCC2)c1
InChIInChI=1S/C13H19N3O/c1-9-6-11(13(14)16-8-9)12(17)7-10-2-4-15-5-3-10/h6,8,10,15H,2-5,7H2,1H3,(H2,14,16)
InChIKeyNEZLTSWDWSIKLY-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.54
Rot. Bonds3

About 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone

1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone (PubChem CID 116560007) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone.

Molecular Properties

Compound Name1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone
PubChem CID116560007
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone
SMILESCc1cnc(N)c(C(=O)CC2CCNCC2)c1
InChIInChI=1S/C13H19N3O/c1-9-6-11(13(14)16-8-9)12(17)7-10-2-4-15-5-3-10/h6,8,10,15H,2-5,7H2,1H3,(H2,14,16)
InChIKeyNEZLTSWDWSIKLY-UHFFFAOYSA-N
XLogP1.54
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-amino-5-methyl-3-pyridinyl)-2-morpholin-2-ylethanone
CID 116586378
(2-amino-5-methyl-3-pyridinyl)-(azetidin-3-yl)methanone
CID 116583846
1-(2-amino-5-methyl-3-pyridinyl)-2-morpholin-3-ylethanone
CID 116595819
(2-amino-5-methyl-3-pyridinyl)-(2,2-dimethylcyclopropyl)methanone
CID 107925462
2-piperidin-4-yl-1-pyrazin-2-ylethanone
CID 116559954
1-(2-amino-5-methyl-3-pyridinyl)-2-ethylsulfanylethanone
CID 65130731
2-amino-1-(2-amino-5-methyl-3-pyridinyl)-2-cyclopropylethanone
CID 130913857
4-amino-1-(2-amino-5-methyl-3-pyridinyl)-3-methylbutan-1-one
CID 116596708
2-(2-aminoethoxy)-1-(2-amino-5-methyl-3-pyridinyl)ethanone
CID 116591054
1-(2-amino-5-methyl-3-pyridinyl)-2-hydroxy-3,3-dimethylbutan-1-one
CID 103456303
(2-amino-5-methyl-3-pyridinyl)-(1,4-dimethylpiperazin-2-yl)methanone
CID 79658548
(2-amino-5-methyl-3-pyridinyl)-morpholin-3-ylmethanone
CID 116576396

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone?
The IUPAC name of 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone (CID 116560007) is 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone.
What is the SMILES notation for 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone?
The canonical SMILES for 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone is Cc1cnc(N)c(C(=O)CC2CCNCC2)c1.
What is the InChIKey of 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone?
The InChIKey is NEZLTSWDWSIKLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-6-11(13(14)16-8-9)12(17)7-10-2-4-15-5-3-10/h6,8,10,15H,2-5,7H2,1H3,(H2,14,16).
What are the key properties of 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone?
1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone has a molecular weight of 233.31 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-5-methyl-3-pyridinyl)-2-piperidin-4-ylethanone is sourced from PubChem (CID 116560007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).