2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid

C16H24N2O3 — CID 107392992

IUPAC2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid
SMILESCCCc1cc(C(=O)O)cc(N2CCCC(C)(OC)C2)n1
InChIInChI=1S/C16H24N2O3/c1-4-6-13-9-12(15(19)20)10-14(17-13)18-8-5-7-16(2,11-18)21-3/h9-10H,4-8,11H2,1-3H3,(H,19,20)
InChIKeyWATQZHPVPPGYFK-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.74
Rot. Bonds5

About 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid

2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid (PubChem CID 107392992) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid
PubChem CID107392992
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid
SMILESCCCc1cc(C(=O)O)cc(N2CCCC(C)(OC)C2)n1
InChIInChI=1S/C16H24N2O3/c1-4-6-13-9-12(15(19)20)10-14(17-13)18-8-5-7-16(2,11-18)21-3/h9-10H,4-8,11H2,1-3H3,(H,19,20)
InChIKeyWATQZHPVPPGYFK-UHFFFAOYSA-N
XLogP2.74
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-2-propylpyrimidin-4-amine
CID 107396346
2-(4-hydroxypiperidin-1-yl)-6-propylpyridine-4-carboxylic acid
CID 113380086
1-[2-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 107395291
4-chloro-2-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)pyrimidine
CID 107394107
2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-6-propylpyridine-4-carboxylic acid
CID 114172366
N-[[6-(3-methoxy-3-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 107395302
2-[2-(hydroxymethyl)azepan-1-yl]-6-propylpyridine-4-carboxylic acid
CID 116635077
2-(3-methoxy-3-methylpiperidin-1-yl)-4,6-dimethylpyridine-3-carboxylic acid
CID 107392995
1-[6-(3-methoxy-3-methylpiperidin-1-yl)pyridazin-3-yl]-N-methylmethanamine
CID 107395284
2-(3-methoxy-3-methylpiperidin-1-yl)-4-propyl-1,3-thiazole-5-carbaldehyde
CID 107395732
2-(4-methylpyrazol-1-yl)-6-propylpyridine-4-carboxylic acid
CID 113379579
6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine
CID 107390510

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid?
The IUPAC name of 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid (CID 107392992) is 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid?
The canonical SMILES for 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid is CCCc1cc(C(=O)O)cc(N2CCCC(C)(OC)C2)n1.
What is the InChIKey of 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid?
The InChIKey is WATQZHPVPPGYFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-4-6-13-9-12(15(19)20)10-14(17-13)18-8-5-7-16(2,11-18)21-3/h9-10H,4-8,11H2,1-3H3,(H,19,20).
What are the key properties of 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid?
2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid has a molecular weight of 292.38 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-3-methylpiperidin-1-yl)-6-propylpyridine-4-carboxylic acid is sourced from PubChem (CID 107392992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).