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

C14H21N3O2 — CID 62233605

IUPAC(3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone
SMILESCCOC1CCCN(C(=O)c2cccc(NC)n2)C1
InChIInChI=1S/C14H21N3O2/c1-3-19-11-6-5-9-17(10-11)14(18)12-7-4-8-13(15-2)16-12/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,15,16)
InChIKeyHKVLMAYRFLXSGD-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.76
Rot. Bonds4

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

(3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone (PubChem CID 62233605) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone.

Molecular Properties

Compound Name(3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone
PubChem CID62233605
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name(3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone
SMILESCCOC1CCCN(C(=O)c2cccc(NC)n2)C1
InChIInChI=1S/C14H21N3O2/c1-3-19-11-6-5-9-17(10-11)14(18)12-7-4-8-13(15-2)16-12/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,15,16)
InChIKeyHKVLMAYRFLXSGD-UHFFFAOYSA-N
XLogP1.76
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-ethoxypiperidin-1-yl)-[6-(propan-2-ylamino)-2-pyridinyl]methanone
CID 115498252
(6-chloro-2-pyridinyl)-(3-propoxypiperidin-1-yl)methanone
CID 62233136
ethyl 1-[6-(cyclopropylamino)pyridine-2-carbonyl]piperidine-3-carboxylate
CID 84571140
(4-ethoxypiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 62239996
(2,3-difluorophenyl)-(3-ethoxypiperidin-1-yl)methanone
CID 62662335
(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-[6-(methylamino)-2-pyridinyl]methanone
CID 81199724
(3,4-dimethylpyrrolidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone
CID 79181819
(3-ethoxypiperidin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 107375356
(3-ethoxypiperidin-1-yl)-(2-methylphenyl)methanone
CID 42656402
(3-chlorophenyl)-(3-ethoxypiperidin-1-yl)methanone
CID 42656405
[4-(aminomethyl)phenyl]-(3-ethoxypiperidin-1-yl)methanone
CID 54985369
[3-(methoxymethyl)piperidin-1-yl]-[6-(propan-2-ylamino)-2-pyridinyl]methanone
CID 106589203

Frequently Asked Questions

What is the IUPAC name of (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone?
The IUPAC name of (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone (CID 62233605) is (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone.
What is the SMILES notation for (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone?
The canonical SMILES for (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone is CCOC1CCCN(C(=O)c2cccc(NC)n2)C1.
What is the InChIKey of (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone?
The InChIKey is HKVLMAYRFLXSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-3-19-11-6-5-9-17(10-11)14(18)12-7-4-8-13(15-2)16-12/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,15,16).
What are the key properties of (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone?
(3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone has a molecular weight of 263.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone is sourced from PubChem (CID 62233605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).