[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone

C17H25N3O — CID 3192324

IUPAC[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone
SMILESCC1CCCCN1c1ncccc1C(=O)N1CCCCC1
InChIInChI=1S/C17H25N3O/c1-14-8-3-6-13-20(14)16-15(9-7-10-18-16)17(21)19-11-4-2-5-12-19/h7,9-10,14H,2-6,8,11-13H2,1H3
InChIKeyYKTFGDNPMBHMEX-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.09
Rot. Bonds2

About [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone

[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone (PubChem CID 3192324) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone
PubChem CID3192324
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone
SMILESCC1CCCCN1c1ncccc1C(=O)N1CCCCC1
InChIInChI=1S/C17H25N3O/c1-14-8-3-6-13-20(14)16-15(9-7-10-18-16)17(21)19-11-4-2-5-12-19/h7,9-10,14H,2-6,8,11-13H2,1H3
InChIKeyYKTFGDNPMBHMEX-UHFFFAOYSA-N
XLogP3.09
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone with MolForge

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Related Compounds

(3-methylpiperidin-1-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 84576155
1-[4-(2-piperidin-1-ylpyridine-3-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 56813825
[2-[(3R,4R)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 72918907
[2-(azepan-1-yl)-3-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone
CID 84576964
[2-(2-methylpiperidin-1-yl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 166191035
(2-bromo-3-pyridinyl)-(2-methylazepan-1-yl)methanone
CID 103755413
1-[2-(2-ethylazepan-1-yl)-3-pyridinyl]ethanone
CID 114055606
(3S,4S)-4-cyclopropyl-1-[3-(piperidine-1-carbonyl)-2-pyridinyl]pyrrolidine-3-carboxylic acid
CID 86283173
2-[(2R)-2-methylpiperidin-1-yl]-3-(trifluoromethyl)pyridine
CID 125486842
2-(2,3-dimethylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 62125386
(3,5-dimethylpiperidin-1-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 84575076
(2-methylpiperidin-1-yl)-(2-morpholin-4-yl-3-pyridinyl)methanone
CID 84577108

Frequently Asked Questions

What is the IUPAC name of [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone?
The IUPAC name of [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone (CID 3192324) is [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone.
What is the SMILES notation for [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone?
The canonical SMILES for [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone is CC1CCCCN1c1ncccc1C(=O)N1CCCCC1.
What is the InChIKey of [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone?
The InChIKey is YKTFGDNPMBHMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-14-8-3-6-13-20(14)16-15(9-7-10-18-16)17(21)19-11-4-2-5-12-19/h7,9-10,14H,2-6,8,11-13H2,1H3.
What are the key properties of [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone?
[2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone has a molecular weight of 287.41 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 3192324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).