3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid

C14H18N2O4 — CID 62217819

IUPAC3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid
SMILESO=C(O)CCC1CCN(C(=O)c2ncccc2O)CC1
InChIInChI=1S/C14H18N2O4/c17-11-2-1-7-15-13(11)14(20)16-8-5-10(6-9-16)3-4-12(18)19/h1-2,7,10,17H,3-6,8-9H2,(H,18,19)
InChIKeyKDNWYFGYRXTIHM-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.50
Rot. Bonds4

About 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid

3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid (PubChem CID 62217819) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid.

Molecular Properties

Compound Name3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid
PubChem CID62217819
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid
SMILESO=C(O)CCC1CCN(C(=O)c2ncccc2O)CC1
InChIInChI=1S/C14H18N2O4/c17-11-2-1-7-15-13(11)14(20)16-8-5-10(6-9-16)3-4-12(18)19/h1-2,7,10,17H,3-6,8-9H2,(H,18,19)
InChIKeyKDNWYFGYRXTIHM-UHFFFAOYSA-N
XLogP1.50
TPSA90.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic 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

(3-hydroxy-2-pyridinyl)-(4-propylpiperidin-1-yl)methanone
CID 62205969
3-[1-(2-hydroxybenzoyl)piperidin-4-yl]propanoic acid
CID 62216443
[4-(ethylaminomethyl)piperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 80552354
azocan-1-yl-(3-hydroxy-2-pyridinyl)methanone
CID 54861395
[4-(1-hydroxyethyl)piperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 104954674
3-(1-pyrimidin-2-ylpiperidin-4-yl)propanoic acid
CID 62216311
3-[1-(2,4-dihydroxybenzoyl)piperidin-4-yl]propanoic acid
CID 62218166
2-[1-(3-bromopyridine-2-carbonyl)pyrrolidin-3-yl]acetic acid
CID 107517164
(3-hydroxy-2-pyridinyl)-thiomorpholin-4-ylmethanone
CID 60923480
3-[1-(1-cyclopropylpyrrole-2-carbonyl)piperidin-4-yl]propanoic acid
CID 62217489
3-[1-(5-fluoro-2-hydroxybenzoyl)piperidin-4-yl]propanoic acid
CID 115298494
[4-[4-(2-hydroxyethyl)piperazin-1-yl]piperidin-1-yl]-(3-hydroxy-2-pyridinyl)methanone
CID 91795995

Frequently Asked Questions

What is the IUPAC name of 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid?
The IUPAC name of 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid (CID 62217819) is 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid.
What is the SMILES notation for 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid?
The canonical SMILES for 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid is O=C(O)CCC1CCN(C(=O)c2ncccc2O)CC1.
What is the InChIKey of 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid?
The InChIKey is KDNWYFGYRXTIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c17-11-2-1-7-15-13(11)14(20)16-8-5-10(6-9-16)3-4-12(18)19/h1-2,7,10,17H,3-6,8-9H2,(H,18,19).
What are the key properties of 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid?
3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid has a molecular weight of 278.31 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]propanoic acid is sourced from PubChem (CID 62217819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).