N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide

C15H21N3O — CID 61230562

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccccn1)C1CC2CCC(C1)N2
InChIInChI=1S/C15H21N3O/c1-2-18(15(19)14-5-3-4-8-16-14)13-9-11-6-7-12(10-13)17-11/h3-5,8,11-13,17H,2,6-7,9-10H2,1H3
InChIKeyZEEGGXBJACKMMP-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.83
Rot. Bonds3

About N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide (PubChem CID 61230562) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide
PubChem CID61230562
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccccn1)C1CC2CCC(C1)N2
InChIInChI=1S/C15H21N3O/c1-2-18(15(19)14-5-3-4-8-16-14)13-9-11-6-7-12(10-13)17-11/h3-5,8,11-13,17H,2,6-7,9-10H2,1H3
InChIKeyZEEGGXBJACKMMP-UHFFFAOYSA-N
XLogP1.83
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.83
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-ethylpyridine-2-carboxamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide (CID 61230562) is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide is CCN(C(=O)c1ccccn1)C1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide?
The InChIKey is ZEEGGXBJACKMMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-2-18(15(19)14-5-3-4-8-16-14)13-9-11-6-7-12(10-13)17-11/h3-5,8,11-13,17H,2,6-7,9-10H2,1H3.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-2-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 1.83, 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-ethylpyridine-2-carboxamide is sourced from PubChem (CID 61230562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).