(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone

C15H23N3O — CID 81236942

IUPAC(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
SMILESCCNc1ccncc1C(=O)N1C(C)CCCC1C
InChIInChI=1S/C15H23N3O/c1-4-17-14-8-9-16-10-13(14)15(19)18-11(2)6-5-7-12(18)3/h8-12H,4-7H2,1-3H3,(H,16,17)
InChIKeyCEGGZVZYQFEKSV-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.92
Rot. Bonds3

About (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone

(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone (PubChem CID 81236942) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone.

Molecular Properties

Compound Name(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
PubChem CID81236942
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
SMILESCCNc1ccncc1C(=O)N1C(C)CCCC1C
InChIInChI=1S/C15H23N3O/c1-4-17-14-8-9-16-10-13(14)15(19)18-11(2)6-5-7-12(18)3/h8-12H,4-7H2,1-3H3,(H,16,17)
InChIKeyCEGGZVZYQFEKSV-UHFFFAOYSA-N
XLogP2.92
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 ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S,6R)-2,6-dimethylpiperidin-1-yl]-(4-hydrazinyl-3-pyridinyl)methanone
CID 104968881
[4-(ethylamino)-3-pyridinyl]-(2-methylpyrrolidin-1-yl)methanone
CID 81234090
[4-(ethylamino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 81236620
[4-(ethylamino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 81236663
(3,5-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
CID 81236821
[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone
CID 81241066
(2-ethyl-5-methylpyrrolidin-1-yl)-(4-hydrazinyl-3-pyridinyl)methanone
CID 83222083
N-(cyclopentylmethyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236600
[4-(ethylamino)-3-pyridinyl]-(3-ethylpyrrolidin-1-yl)methanone
CID 113418729
(2-methylazepan-1-yl)-[4-(propylamino)-3-pyridinyl]methanone
CID 81245049
N-(2,3-dimethylcyclohexyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236631
[4-(ethylamino)-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 81240012

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone?
The IUPAC name of (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone (CID 81236942) is (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone.
What is the SMILES notation for (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone?
The canonical SMILES for (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone is CCNc1ccncc1C(=O)N1C(C)CCCC1C.
What is the InChIKey of (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone?
The InChIKey is CEGGZVZYQFEKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-4-17-14-8-9-16-10-13(14)15(19)18-11(2)6-5-7-12(18)3/h8-12H,4-7H2,1-3H3,(H,16,17).
What are the key properties of (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone?
(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone has a molecular weight of 261.37 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone is sourced from PubChem (CID 81236942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).