6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid

C20H29N3O3 — CID 69353827

IUPAC6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)nc1
InChIInChI=1S/C20H29N3O3/c24-20(25)15-4-5-19(21-14-15)23-12-8-18(9-13-23)26-17-6-10-22(11-7-17)16-2-1-3-16/h4-5,14,16-18H,1-3,6-13H2,(H,24,25)
InChIKeyITPLZXFUEBRDKJ-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.78
Rot. Bonds5

About 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid

6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid (PubChem CID 69353827) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid
PubChem CID69353827
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC Name6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)nc1
InChIInChI=1S/C20H29N3O3/c24-20(25)15-4-5-19(21-14-15)23-12-8-18(9-13-23)26-17-6-10-22(11-7-17)16-2-1-3-16/h4-5,14,16-18H,1-3,6-13H2,(H,24,25)
InChIKeyITPLZXFUEBRDKJ-UHFFFAOYSA-N
XLogP2.78
TPSA65.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid
CID 71212709
6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)pyridine-3-carboxylic acid
CID 79935281
4-[6-(4-cyclopentylpiperazin-1-yl)-3-pyridinyl]benzoic acid
CID 67144831
[1-(5-carbamoyl-2-pyridinyl)piperidin-4-yl] 4-cyclopentylpiperazine-1-carboxylate
CID 71523156
6-piperidin-1-ylpyridine-3-carboxylic acid
CID 2794761
6-[4-(dimethylamino)piperidin-1-yl]pyridine-3-carboxylic acid
CID 43586285
6-[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]piperazin-1-yl]pyridine-3-carboxylic acid
CID 67560935
[4-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]phenyl]-piperidin-1-ylmethanone
CID 69354891
6-(4-methylsulfanylazepan-1-yl)pyridine-3-carboxylic acid
CID 114237506
6-(3-methoxyazetidin-1-yl)pyridine-3-carboxylic acid
CID 121201375
2-[1-(5-carbamoyl-2-pyridinyl)piperidin-4-yl]oxyacetic acid
CID 63903910
6-[(3R,4R)-4-hydroxy-3-methylpiperidin-1-yl]pyridine-3-carboxylic acid
CID 129445649

Frequently Asked Questions

What is the IUPAC name of 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid?
The IUPAC name of 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid (CID 69353827) is 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid is O=C(O)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)nc1.
What is the InChIKey of 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid?
The InChIKey is ITPLZXFUEBRDKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c24-20(25)15-4-5-19(21-14-15)23-12-8-18(9-13-23)26-17-6-10-22(11-7-17)16-2-1-3-16/h4-5,14,16-18H,1-3,6-13H2,(H,24,25).
What are the key properties of 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid?
6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid has a molecular weight of 359.47 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid is sourced from PubChem (CID 69353827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).