piperidin-4-yl pentanoate

C10H19NO2 — CID 45091374

IUPACpiperidin-4-yl pentanoate
SMILESCCCCC(=O)OC1CCNCC1
InChIInChI=1S/C10H19NO2/c1-2-3-4-10(12)13-9-5-7-11-8-6-9/h9,11H,2-8H2,1H3
InChIKeyQISQNBJNJNBVRU-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.47
Rot. Bonds4

About piperidin-4-yl pentanoate

piperidin-4-yl pentanoate (PubChem CID 45091374) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is piperidin-4-yl pentanoate.

Molecular Properties

Compound Namepiperidin-4-yl pentanoate
PubChem CID45091374
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Namepiperidin-4-yl pentanoate
SMILESCCCCC(=O)OC1CCNCC1
InChIInChI=1S/C10H19NO2/c1-2-3-4-10(12)13-9-5-7-11-8-6-9/h9,11H,2-8H2,1H3
InChIKeyQISQNBJNJNBVRU-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl decanoate
CID 154321154
cyclobutyl pentadecanoate
CID 46229794
dipiperidin-4-yl decanedioate;2,2,6,6-tetramethyl-1-octoxypiperazine
CID 174906692
piperidin-4-yl 3-cyclopropylpropanoate
CID 158472196
oxetan-3-yl pentanoate
CID 54206985
piperidin-4-yl 2-methoxyacetate
CID 53410127
[4-[4-(4-propylcyclohexyl)cyclohexyl]cyclohexyl] pentanoate
CID 70424682
cyclopentyl 3-piperidin-4-yloxypropanoate
CID 55252240
(1-hydroxypiperidin-4-yl) octanoate
CID 21019115
(4-hexadecanoyloxycyclohexyl) (Z)-octadec-9-enoate
CID 101255387
[4-[(Z)-octadec-9-enoyl]oxycyclohexyl] (Z)-octadec-9-enoate
CID 101255389
(3-aminopiperidin-4-yl) nonanoate
CID 166978005

Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl pentanoate?
The IUPAC name of piperidin-4-yl pentanoate (CID 45091374) is piperidin-4-yl pentanoate.
What is the SMILES notation for piperidin-4-yl pentanoate?
The canonical SMILES for piperidin-4-yl pentanoate is CCCCC(=O)OC1CCNCC1.
What is the InChIKey of piperidin-4-yl pentanoate?
The InChIKey is QISQNBJNJNBVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-3-4-10(12)13-9-5-7-11-8-6-9/h9,11H,2-8H2,1H3.
What are the key properties of piperidin-4-yl pentanoate?
piperidin-4-yl pentanoate has a molecular weight of 185.27 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 pentanoate is sourced from PubChem (CID 45091374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).