piperidin-4-yl 2-aminoacetate

C7H14N2O2 — CID 91483112

IUPACpiperidin-4-yl 2-aminoacetate
SMILESNCC(=O)OC1CCNCC1
InChIInChI=1S/C7H14N2O2/c8-5-7(10)11-6-1-3-9-4-2-6/h6,9H,1-5,8H2
InChIKeyACJLRYAMZLWXCW-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.76
Rot. Bonds2

About piperidin-4-yl 2-aminoacetate

piperidin-4-yl 2-aminoacetate (PubChem CID 91483112) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is piperidin-4-yl 2-aminoacetate.

Molecular Properties

Compound Namepiperidin-4-yl 2-aminoacetate
PubChem CID91483112
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Namepiperidin-4-yl 2-aminoacetate
SMILESNCC(=O)OC1CCNCC1
InChIInChI=1S/C7H14N2O2/c8-5-7(10)11-6-1-3-9-4-2-6/h6,9H,1-5,8H2
InChIKeyACJLRYAMZLWXCW-UHFFFAOYSA-N
XLogP-0.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-Propionyloxypiperidine
CID 12410235
Piperidin-4-yl acetate hydrochloride
CID 12694334
Piperidin-4-yl acetate
CID 11252075
3-Piperidinyl acetate
CID 21490229
[(3R)-piperidin-3-yl] acetate
CID 15181869
(1-methylpiperidin-4-yl) (2S)-2-aminopropanoate
CID 61284777
(1-Methylpiperidin-4-yl) 2-aminopropanoate
CID 61285149
piperidin-4-yl (2S)-2-aminopropanoate
CID 67040783
4-Piperazin-1-ylbutan-2-yl 2-aminoacetate
CID 67470130
Piperidin-4-yl 3-aminopropanoate
CID 67829463
(6S)-6-ethylmorpholin-2-one
CID 69950405
CID 70060770
CID 70060770

Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl 2-aminoacetate?
The IUPAC name of piperidin-4-yl 2-aminoacetate (CID 91483112) is piperidin-4-yl 2-aminoacetate.
What is the SMILES notation for piperidin-4-yl 2-aminoacetate?
The canonical SMILES for piperidin-4-yl 2-aminoacetate is NCC(=O)OC1CCNCC1.
What is the InChIKey of piperidin-4-yl 2-aminoacetate?
The InChIKey is ACJLRYAMZLWXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c8-5-7(10)11-6-1-3-9-4-2-6/h6,9H,1-5,8H2.
What are the key properties of piperidin-4-yl 2-aminoacetate?
piperidin-4-yl 2-aminoacetate has a molecular weight of 158.20 g/mol, XLogP of -0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl 2-aminoacetate is sourced from PubChem (CID 91483112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).