[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone

C19H29N3O — CID 109240600

IUPAC[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
SMILESCCC1CCCCN1c1cncc(C(=O)N2CCCC(C)C2)c1
InChIInChI=1S/C19H29N3O/c1-3-17-8-4-5-10-22(17)18-11-16(12-20-13-18)19(23)21-9-6-7-15(2)14-21/h11-13,15,17H,3-10,14H2,1-2H3
InChIKeyGIECVBBURPIGPI-UHFFFAOYSA-N
MW315.46 g/mol
LogP3.72
Rot. Bonds3

About [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone

[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone (PubChem CID 109240600) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
PubChem CID109240600
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
SMILESCCC1CCCCN1c1cncc(C(=O)N2CCCC(C)C2)c1
InChIInChI=1S/C19H29N3O/c1-3-17-8-4-5-10-22(17)18-11-16(12-20-13-18)19(23)21-9-6-7-15(2)14-21/h11-13,15,17H,3-10,14H2,1-2H3
InChIKeyGIECVBBURPIGPI-UHFFFAOYSA-N
XLogP3.72
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methylpiperidin-1-yl)-(5-piperidin-1-yl-3-pyridinyl)methanone
CID 109226519
[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(4-phenylpiperazin-1-yl)methanone
CID 109237515
N-cyclopentyl-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109225954
(5-bromo-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 23907944
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyridine-3-carboxamide
CID 109239784
azepan-1-yl-[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]methanone
CID 109107415
N-benzyl-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109231683
N-(2,6-dimethylphenyl)-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109240615
(2-ethylpiperidin-1-yl)-[2-(3-methylpiperidine-1-carbonyl)-4-pyridinyl]methanone
CID 109090134
5-(2-ethylpiperidin-1-yl)-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 109240663
[5-(4-methylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone
CID 109226257
[2-(2-ethylpiperidin-1-yl)pyrimidin-5-yl]-pyrrolidin-1-ylmethanone
CID 109249279

Frequently Asked Questions

What is the IUPAC name of [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone (CID 109240600) is [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone is CCC1CCCCN1c1cncc(C(=O)N2CCCC(C)C2)c1.
What is the InChIKey of [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone?
The InChIKey is GIECVBBURPIGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c1-3-17-8-4-5-10-22(17)18-11-16(12-20-13-18)19(23)21-9-6-7-15(2)14-21/h11-13,15,17H,3-10,14H2,1-2H3.
What are the key properties of [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone?
[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone has a molecular weight of 315.46 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 109240600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).