N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide

C15H26N2O2 — CID 61232465

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide
SMILESCCN(C(=O)C1CCOCC1)C1CC2CCC(C1)N2
InChIInChI=1S/C15H26N2O2/c1-2-17(15(18)11-5-7-19-8-6-11)14-9-12-3-4-13(10-14)16-12/h11-14,16H,2-10H2,1H3
InChIKeyPZBRUZYTCGGKFC-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.54
Rot. Bonds3

About N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide (PubChem CID 61232465) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide
PubChem CID61232465
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide
SMILESCCN(C(=O)C1CCOCC1)C1CC2CCC(C1)N2
InChIInChI=1S/C15H26N2O2/c1-2-17(15(18)11-5-7-19-8-6-11)14-9-12-3-4-13(10-14)16-12/h11-14,16H,2-10H2,1H3
InChIKeyPZBRUZYTCGGKFC-UHFFFAOYSA-N
XLogP1.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide (CID 61232465) is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide is CCN(C(=O)C1CCOCC1)C1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide?
The InChIKey is PZBRUZYTCGGKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-2-17(15(18)11-5-7-19-8-6-11)14-9-12-3-4-13(10-14)16-12/h11-14,16H,2-10H2,1H3.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide has a molecular weight of 266.38 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxane-4-carboxamide is sourced from PubChem (CID 61232465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).