4-piperidin-4-yloxypiperidine-1-carboxylic acid

C11H20N2O3 — CID 69156881

IUPAC4-piperidin-4-yloxypiperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(OC2CCNCC2)CC1
InChIInChI=1S/C11H20N2O3/c14-11(15)13-7-3-10(4-8-13)16-9-1-5-12-6-2-9/h9-10,12H,1-8H2,(H,14,15)
InChIKeyRXXSBLWEGSVNDA-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.90
Rot. Bonds2

About 4-piperidin-4-yloxypiperidine-1-carboxylic acid

4-piperidin-4-yloxypiperidine-1-carboxylic acid (PubChem CID 69156881) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 4-piperidin-4-yloxypiperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-piperidin-4-yloxypiperidine-1-carboxylic acid
PubChem CID69156881
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name4-piperidin-4-yloxypiperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(OC2CCNCC2)CC1
InChIInChI=1S/C11H20N2O3/c14-11(15)13-7-3-10(4-8-13)16-9-1-5-12-6-2-9/h9-10,12H,1-8H2,(H,14,15)
InChIKeyRXXSBLWEGSVNDA-UHFFFAOYSA-N
XLogP0.90
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Piperidin-4-yloxy)-piperidine-1-carboxylic acid t-butyl ester
CID 53407862
(3R,4R)-3-fluoro-4-piperidin-4-yloxypiperidine-1-carboxylic acid
CID 156177688
tert-butyl (3R,4R)-3-fluoro-4-(piperidin-4-yloxy)piperidine-1-carboxylate
CID 156187219
tert-butyl (3R,4S)-3-fluoro-4-piperidin-4-yloxypiperidine-1-carboxylate
CID 178975663
Piperidine;piperidine-1-carboxylic acid
CID 15122514
4-(Butylcarbamoyloxy)piperidine-1-carboxylic acid
CID 19807181
Tert-butyl 4-propoxypiperidine-1-carboxylate;piperidine
CID 21989989
4-(Piperidine-1-carbonyloxy)piperidine-1-carboxylic acid
CID 22401230
methyl N-(3-piperidin-4-yloxypropyl)carbamate
CID 63871088
1-Oxa-4,9-diazaspiro[5.5]undecane-4-carboxylic acid
CID 66698019
[1-(Oxan-4-yl)piperidin-4-yl]carbamic acid
CID 66819756
1-Oxa-4,9-diazaspiro[5.5]undecane-9-carboxylic acid;hydrochloride
CID 66964254

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-4-yloxypiperidine-1-carboxylic acid?
The IUPAC name of 4-piperidin-4-yloxypiperidine-1-carboxylic acid (CID 69156881) is 4-piperidin-4-yloxypiperidine-1-carboxylic acid.
What is the SMILES notation for 4-piperidin-4-yloxypiperidine-1-carboxylic acid?
The canonical SMILES for 4-piperidin-4-yloxypiperidine-1-carboxylic acid is O=C(O)N1CCC(OC2CCNCC2)CC1.
What is the InChIKey of 4-piperidin-4-yloxypiperidine-1-carboxylic acid?
The InChIKey is RXXSBLWEGSVNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-11(15)13-7-3-10(4-8-13)16-9-1-5-12-6-2-9/h9-10,12H,1-8H2,(H,14,15).
What are the key properties of 4-piperidin-4-yloxypiperidine-1-carboxylic acid?
4-piperidin-4-yloxypiperidine-1-carboxylic acid has a molecular weight of 228.29 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-4-yloxypiperidine-1-carboxylic acid is sourced from PubChem (CID 69156881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).