1-pyridin-4-ylpiperidine-4-carboxylic acid

C11H14N2O2 — CID 1268289

IUPAC1-pyridin-4-ylpiperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(c2ccncc2)CC1
InChIInChI=1S/C11H14N2O2/c14-11(15)9-3-7-13(8-4-9)10-1-5-12-6-2-10/h1-2,5-6,9H,3-4,7-8H2,(H,14,15)
InChIKeyUISWRUUBFFHGLE-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.38
Rot. Bonds2

About 1-pyridin-4-ylpiperidine-4-carboxylic acid

1-pyridin-4-ylpiperidine-4-carboxylic acid (PubChem CID 1268289) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-pyridin-4-ylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-pyridin-4-ylpiperidine-4-carboxylic acid
PubChem CID1268289
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name1-pyridin-4-ylpiperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(c2ccncc2)CC1
InChIInChI=1S/C11H14N2O2/c14-11(15)9-3-7-13(8-4-9)10-1-5-12-6-2-10/h1-2,5-6,9H,3-4,7-8H2,(H,14,15)
InChIKeyUISWRUUBFFHGLE-UHFFFAOYSA-N
XLogP1.38
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-pyridin-4-ylpiperidine-4-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

1-(Pyridin-4-ylmethyl)piperidine-4-carboxylic acid
CID 2761157
Pyridine, 4-(4-methyl-1-piperidinyl)-
CID 157352
1-Pyridin-2-ylmethyl-piperidine-4-carboxylic acid hydrochloride
CID 16195169
3-[4-(2-Pyridin-4-yl-2,8-diaza-spiro[4.5]decane-8-carbonyl)-piperidin-1-yl]-butyric acid
CID 44268296
3-[4-(2-Pyridin-4-yl-2,8-diaza-spiro[4.5]decane-8-carbonyl)-piperidin-1-yl]-propionic acid
CID 44268312
5-Oxo-5-(9-pyridin-4-yl-3,9-diaza-spiro[5.5]undec-3-yl)-pentanoic acid
CID 44459507
6-Oxo-6-(9-pyridin-4-yl-3,9-diaza-spiro[5.5]undec-3-yl)-hexanoic acid
CID 44459874
1-(Pyridin-3-ylmethyl)piperidine-4-carboxylic acid;hydrochloride
CID 16192964
N-Pyridin-4-yl-succinamic acid
CID 818170
6-Oxo-6-(8-pyridin-4-yl-2,8-diaza-spiro[4.5]dec-2-yl)-hexanoic acid
CID 9950075
4-[(2-Pyridin-4-yl-2,8-diaza-spiro[4.5]decane-8-carbonyl)-amino]-butyric acid
CID 44268287
1-(2-Pyridin-4-yl-2,8-diaza-spiro[4.5]decane-8-carbonyl)-piperidine-4-carboxylic acid
CID 44268364

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-4-ylpiperidine-4-carboxylic acid?
The IUPAC name of 1-pyridin-4-ylpiperidine-4-carboxylic acid (CID 1268289) is 1-pyridin-4-ylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-pyridin-4-ylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-pyridin-4-ylpiperidine-4-carboxylic acid is O=C(O)C1CCN(c2ccncc2)CC1.
What is the InChIKey of 1-pyridin-4-ylpiperidine-4-carboxylic acid?
The InChIKey is UISWRUUBFFHGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-11(15)9-3-7-13(8-4-9)10-1-5-12-6-2-10/h1-2,5-6,9H,3-4,7-8H2,(H,14,15).
What are the key properties of 1-pyridin-4-ylpiperidine-4-carboxylic acid?
1-pyridin-4-ylpiperidine-4-carboxylic acid has a molecular weight of 206.25 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-4-ylpiperidine-4-carboxylic acid is sourced from PubChem (CID 1268289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).