(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone

C15H23N3O — CID 62240105

IUPAC(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
SMILESCCCNc1cccc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C15H23N3O/c1-3-9-16-14-6-4-5-13(17-14)15(19)18-10-7-12(2)8-11-18/h4-6,12H,3,7-11H2,1-2H3,(H,16,17)
InChIKeyNPRWBYIDGWQDDJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds4

About (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone

(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone (PubChem CID 62240105) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone.

Molecular Properties

Compound Name(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
PubChem CID62240105
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
SMILESCCCNc1cccc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C15H23N3O/c1-3-9-16-14-6-4-5-13(17-14)15(19)18-10-7-12(2)8-11-18/h4-6,12H,3,7-11H2,1-2H3,(H,16,17)
InChIKeyNPRWBYIDGWQDDJ-UHFFFAOYSA-N
XLogP2.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(propylamino)-2-pyridinyl]-(4-propylpiperidin-1-yl)methanone
CID 62232698
(4-ethoxypiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 62239996
piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone
CID 62239787
(3,4-dimethylpyrrolidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 79180595
(4-hydroxy-4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 81109407
(4-methyl-1,4-diazepan-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 62240932
1,4-oxazepan-4-yl-[6-(propylamino)-2-pyridinyl]methanone
CID 62966972
[6-(ethylamino)-2-pyridinyl]-[4-(hydroxymethyl)piperidin-1-yl]methanone
CID 55052183
(4-methylpiperidin-1-yl)-[6-(propylamino)pyrimidin-4-yl]methanone
CID 109338249
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-[6-(propylamino)-2-pyridinyl]methanone
CID 65322102
[6-(4-tert-butylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 58211121
[2-(hydroxymethyl)azepan-1-yl]-[6-(propylamino)-2-pyridinyl]methanone
CID 116637902

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone?
The IUPAC name of (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone (CID 62240105) is (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone.
What is the SMILES notation for (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone?
The canonical SMILES for (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone is CCCNc1cccc(C(=O)N2CCC(C)CC2)n1.
What is the InChIKey of (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone?
The InChIKey is NPRWBYIDGWQDDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-9-16-14-6-4-5-13(17-14)15(19)18-10-7-12(2)8-11-18/h4-6,12H,3,7-11H2,1-2H3,(H,16,17).
What are the key properties of (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone?
(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone has a molecular weight of 261.37 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone is sourced from PubChem (CID 62240105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).