2-(diethylamino)ethyl N-piperidin-4-ylcarbamate

C12H25N3O2 — CID 15676972

IUPAC2-(diethylamino)ethyl N-piperidin-4-ylcarbamate
SMILESCCN(CC)CCOC(=O)NC1CCNCC1
InChIInChI=1S/C12H25N3O2/c1-3-15(4-2)9-10-17-12(16)14-11-5-7-13-8-6-11/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyJXFJKSJCIJZYTD-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.81
Rot. Bonds6

About 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate

2-(diethylamino)ethyl N-piperidin-4-ylcarbamate (PubChem CID 15676972) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate.

Molecular Properties

Compound Name2-(diethylamino)ethyl N-piperidin-4-ylcarbamate
PubChem CID15676972
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name2-(diethylamino)ethyl N-piperidin-4-ylcarbamate
SMILESCCN(CC)CCOC(=O)NC1CCNCC1
InChIInChI=1S/C12H25N3O2/c1-3-15(4-2)9-10-17-12(16)14-11-5-7-13-8-6-11/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyJXFJKSJCIJZYTD-UHFFFAOYSA-N
XLogP0.81
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate?
The IUPAC name of 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate (CID 15676972) is 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate.
What is the SMILES notation for 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate?
The canonical SMILES for 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate is CCN(CC)CCOC(=O)NC1CCNCC1.
What is the InChIKey of 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate?
The InChIKey is JXFJKSJCIJZYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-3-15(4-2)9-10-17-12(16)14-11-5-7-13-8-6-11/h11,13H,3-10H2,1-2H3,(H,14,16).
What are the key properties of 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate?
2-(diethylamino)ethyl N-piperidin-4-ylcarbamate has a molecular weight of 243.35 g/mol, XLogP of 0.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)ethyl N-piperidin-4-ylcarbamate is sourced from PubChem (CID 15676972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).