[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone

C15H23N3O — CID 83061594

IUPAC[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)c1ccc(NC)nc1
InChIInChI=1S/C15H23N3O/c1-3-6-13-7-4-5-10-18(13)15(19)12-8-9-14(16-2)17-11-12/h8-9,11,13H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyHDUCQVZJXLHJRO-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.92
Rot. Bonds4

About [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone

[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone (PubChem CID 83061594) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone
PubChem CID83061594
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)c1ccc(NC)nc1
InChIInChI=1S/C15H23N3O/c1-3-6-13-7-4-5-10-18(13)15(19)12-8-9-14(16-2)17-11-12/h8-9,11,13H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyHDUCQVZJXLHJRO-UHFFFAOYSA-N
XLogP2.92
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 ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(hydroxymethyl)pyrrolidin-1-yl]-[6-(methylamino)-3-pyridinyl]methanone
CID 62173422
[6-(ethylamino)-3-pyridinyl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62165751
[5-chloro-2-(methylamino)-4-pyridinyl]-(2-propylpiperidin-1-yl)methanone
CID 114924337
[6-(cyclopropylamino)-3-pyridinyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 97314114
[6-(ethylamino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 55042855
[2-(2-hydroxyethyl)piperidin-1-yl]-[6-(propan-2-ylamino)-3-pyridinyl]methanone
CID 84570849
(2-ethylazepan-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone
CID 104691838
[6-(butan-2-ylamino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109151990
phenyl-(2-propylpiperidin-1-yl)methanone
CID 16637839
(2-ethylpiperidin-1-yl)-[6-(2,3,4-trifluoroanilino)-3-pyridinyl]methanone
CID 109161690
[2-(2-hydroxyethyl)piperidin-1-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 62166096
[5-bromo-2-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone
CID 83061828

Frequently Asked Questions

What is the IUPAC name of [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone?
The IUPAC name of [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone (CID 83061594) is [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone.
What is the SMILES notation for [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone?
The canonical SMILES for [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone is CCCC1CCCCN1C(=O)c1ccc(NC)nc1.
What is the InChIKey of [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone?
The InChIKey is HDUCQVZJXLHJRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-6-13-7-4-5-10-18(13)15(19)12-8-9-14(16-2)17-11-12/h8-9,11,13H,3-7,10H2,1-2H3,(H,16,17).
What are the key properties of [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone?
[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone has a molecular weight of 261.37 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 83061594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).