[6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone

C19H22N2O2 — CID 58211283

IUPAC[6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
SMILESCOc1cccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)c1
InChIInChI=1S/C19H22N2O2/c1-14-9-11-21(12-10-14)19(22)18-8-4-7-17(20-18)15-5-3-6-16(13-15)23-2/h3-8,13-14H,9-12H2,1-2H3
InChIKeyDBMCIVYPIIEERS-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.63
Rot. Bonds3

About [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone

[6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 58211283) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
PubChem CID58211283
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name[6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
SMILESCOc1cccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)c1
InChIInChI=1S/C19H22N2O2/c1-14-9-11-21(12-10-14)19(22)18-8-4-7-17(20-18)15-5-3-6-16(13-15)23-2/h3-8,13-14H,9-12H2,1-2H3
InChIKeyDBMCIVYPIIEERS-UHFFFAOYSA-N
XLogP3.63
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(4-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 58211403
[6-(3-ethenylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 143311427
[6-(4-tert-butylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 58211121
[6-[(3-methoxyphenyl)sulfonylmethyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 58211537
[5-(3-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 2031425
[6-(2,4-difluorophenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 58211385
(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone
CID 62239764
[(3S)-3-[6-(3-methoxyphenyl)-2-pyridinyl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95809539
(4-aminopiperidin-1-yl)-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]methanone
CID 66485063
(4-methylpiperidin-1-yl)-[6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]methanone
CID 58211071
[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-(4-methylpiperidin-1-yl)methanone
CID 26643733
[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-(4-methylpiperidin-1-yl)methanone
CID 20864968

Frequently Asked Questions

What is the IUPAC name of [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone (CID 58211283) is [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone is COc1cccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)c1.
What is the InChIKey of [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is DBMCIVYPIIEERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14-9-11-21(12-10-14)19(22)18-8-4-7-17(20-18)15-5-3-6-16(13-15)23-2/h3-8,13-14H,9-12H2,1-2H3.
What are the key properties of [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
[6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 310.40 g/mol, XLogP of 3.63, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 58211283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).