piperidin-4-yl 3-cyclopropylpropanoate

C11H19NO2 — CID 158472196

IUPACpiperidin-4-yl 3-cyclopropylpropanoate
SMILESO=C(CCC1CC1)OC1CCNCC1
InChIInChI=1S/C11H19NO2/c13-11(4-3-9-1-2-9)14-10-5-7-12-8-6-10/h9-10,12H,1-8H2
InChIKeyHGMGOWIRWHYRSR-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.47
Rot. Bonds4

About piperidin-4-yl 3-cyclopropylpropanoate

piperidin-4-yl 3-cyclopropylpropanoate (PubChem CID 158472196) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is piperidin-4-yl 3-cyclopropylpropanoate.

Molecular Properties

Compound Namepiperidin-4-yl 3-cyclopropylpropanoate
PubChem CID158472196
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Namepiperidin-4-yl 3-cyclopropylpropanoate
SMILESO=C(CCC1CC1)OC1CCNCC1
InChIInChI=1S/C11H19NO2/c13-11(4-3-9-1-2-9)14-10-5-7-12-8-6-10/h9-10,12H,1-8H2
InChIKeyHGMGOWIRWHYRSR-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl 3-cyclopropylpropanoate?
The IUPAC name of piperidin-4-yl 3-cyclopropylpropanoate (CID 158472196) is piperidin-4-yl 3-cyclopropylpropanoate.
What is the SMILES notation for piperidin-4-yl 3-cyclopropylpropanoate?
The canonical SMILES for piperidin-4-yl 3-cyclopropylpropanoate is O=C(CCC1CC1)OC1CCNCC1.
What is the InChIKey of piperidin-4-yl 3-cyclopropylpropanoate?
The InChIKey is HGMGOWIRWHYRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11(4-3-9-1-2-9)14-10-5-7-12-8-6-10/h9-10,12H,1-8H2.
What are the key properties of piperidin-4-yl 3-cyclopropylpropanoate?
piperidin-4-yl 3-cyclopropylpropanoate has a molecular weight of 197.28 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl 3-cyclopropylpropanoate is sourced from PubChem (CID 158472196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).