3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid

C10H18N2O3 — CID 115028740

IUPAC3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid
SMILESO=C(O)C1(O)CCN(C2CCNCC2)C1
InChIInChI=1S/C10H18N2O3/c13-9(14)10(15)3-6-12(7-10)8-1-4-11-5-2-8/h8,11,15H,1-7H2,(H,13,14)
InChIKeyUWJSZRLNDJUSOJ-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.74
Rot. Bonds2

About 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid

3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid (PubChem CID 115028740) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid
PubChem CID115028740
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid
SMILESO=C(O)C1(O)CCN(C2CCNCC2)C1
InChIInChI=1S/C10H18N2O3/c13-9(14)10(15)3-6-12(7-10)8-1-4-11-5-2-8/h8,11,15H,1-7H2,(H,13,14)
InChIKeyUWJSZRLNDJUSOJ-UHFFFAOYSA-N
XLogP-0.74
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-1-piperidin-4-ylazepane-4-carboxylic acid
CID 115055711
3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide
CID 71104083
1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid
CID 115055583
1-cyclopropyl-3-piperazin-1-ylpyrrolidine-3-carboxylic acid
CID 55141799
(3S)-1-piperidin-4-yl-3-(trifluoromethyl)pyrrolidin-3-ol
CID 129320792
4-methyl-1-piperidin-4-ylpiperidin-4-ol;hydrochloride
CID 75464899
4-(3,3-difluoropyrrolidin-1-yl)piperidine
CID 53488020
2-hydroxy-3,5,6,7,8,8a-hexahydro-1H-indolizine-2-carboxylic acid
CID 83906916
3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride
CID 156735226
5-piperidin-4-yl-5-azaspiro[2.5]octane;dihydrochloride
CID 156735083
3-cyclopropyl-1-piperidin-4-ylazetidin-3-ol
CID 130963860
N-[1-hydroxy-4-(4-piperidin-4-ylpiperazin-1-yl)cyclohexyl]formamide
CID 173306267

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid?
The IUPAC name of 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid (CID 115028740) is 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid.
What is the SMILES notation for 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid?
The canonical SMILES for 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid is O=C(O)C1(O)CCN(C2CCNCC2)C1.
What is the InChIKey of 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid?
The InChIKey is UWJSZRLNDJUSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c13-9(14)10(15)3-6-12(7-10)8-1-4-11-5-2-8/h8,11,15H,1-7H2,(H,13,14).
What are the key properties of 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid?
3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid has a molecular weight of 214.26 g/mol, XLogP of -0.74, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid is sourced from PubChem (CID 115028740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).