[2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone

C19H22N2O2 — CID 102542591

IUPAC[2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone
SMILESCOc1ccc(C2CCCCN2C(=O)c2ccccc2)c(C)n1
InChIInChI=1S/C19H22N2O2/c1-14-16(11-12-18(20-14)23-2)17-10-6-7-13-21(17)19(22)15-8-4-3-5-9-15/h3-5,8-9,11-12,17H,6-7,10,13H2,1-2H3
InChIKeyJRNFWACZUUGZSX-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.77
Rot. Bonds3

About [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone

[2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone (PubChem CID 102542591) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone.

Molecular Properties

Compound Name[2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone
PubChem CID102542591
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name[2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone
SMILESCOc1ccc(C2CCCCN2C(=O)c2ccccc2)c(C)n1
InChIInChI=1S/C19H22N2O2/c1-14-16(11-12-18(20-14)23-2)17-10-6-7-13-21(17)19(22)15-8-4-3-5-9-15/h3-5,8-9,11-12,17H,6-7,10,13H2,1-2H3
InChIKeyJRNFWACZUUGZSX-UHFFFAOYSA-N
XLogP3.77
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 ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(6-amino-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone
CID 102542837
[2-[6-(dimethylamino)-2-methyl-3-pyridinyl]pyrrolidin-1-yl]-phenylmethanone
CID 102542918
6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine
CID 102542565
1-[3-(2-chlorophenyl)-4-(6-methoxy-2-methyl-3-pyridinyl)benzoyl]pyrrolidine-2-carboxylic acid
CID 67257444
[2-(2-chlorophenyl)pyrrolidin-1-yl]-phenylmethanone
CID 61061635
phenyl-[2-(2-piperidin-1-yl-3-pyridinyl)piperidin-1-yl]methanone
CID 102541555
[2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]azepan-1-yl]-phenylmethanone
CID 75475073
2-(1-benzoylpiperidin-2-yl)-5,6-dimethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 123507904
[(2S)-2-(dimethoxymethyl)piperidin-1-yl]-phenylmethanone
CID 44540070
(2-phenylpiperidin-1-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 119033998
[(2R)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-phenylmethanone
CID 813034
[4-(aminomethyl)phenyl]-[2-(2-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 119316524

Frequently Asked Questions

What is the IUPAC name of [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone?
The IUPAC name of [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone (CID 102542591) is [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone.
What is the SMILES notation for [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone?
The canonical SMILES for [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone is COc1ccc(C2CCCCN2C(=O)c2ccccc2)c(C)n1.
What is the InChIKey of [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone?
The InChIKey is JRNFWACZUUGZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14-16(11-12-18(20-14)23-2)17-10-6-7-13-21(17)19(22)15-8-4-3-5-9-15/h3-5,8-9,11-12,17H,6-7,10,13H2,1-2H3.
What are the key properties of [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone?
[2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone has a molecular weight of 310.40 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(6-methoxy-2-methyl-3-pyridinyl)piperidin-1-yl]-phenylmethanone is sourced from PubChem (CID 102542591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).