N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide

C22H32N4O — CID 166024726

IUPACN-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide
SMILESO=C(CN1C2CCCC1CC2)Nc1ccc(N2CC3CCC(CC3)C2)nc1
InChIInChI=1S/C22H32N4O/c27-22(15-26-19-2-1-3-20(26)10-9-19)24-18-8-11-21(23-12-18)25-13-16-4-5-17(14-25)7-6-16/h8,11-12,16-17,19-20H,1-7,9-10,13-15H2,(H,24,27)
InChIKeyUJGJYJAGLULXSQ-UHFFFAOYSA-N
MW368.53 g/mol
LogP3.66
Rot. Bonds4

About N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide

N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide (PubChem CID 166024726) has the molecular formula C22H32N4O and a molecular weight of 368.53 g/mol. Its IUPAC name is N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide.

Molecular Properties

Compound NameN-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide
PubChem CID166024726
Molecular FormulaC22H32N4O
Molecular Weight368.53 g/mol
Exact Mass368.26
IUPAC NameN-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide
SMILESO=C(CN1C2CCCC1CC2)Nc1ccc(N2CC3CCC(CC3)C2)nc1
InChIInChI=1S/C22H32N4O/c27-22(15-26-19-2-1-3-20(26)10-9-19)24-18-8-11-21(23-12-18)25-13-16-4-5-17(14-25)7-6-16/h8,11-12,16-17,19-20H,1-7,9-10,13-15H2,(H,24,27)
InChIKeyUJGJYJAGLULXSQ-UHFFFAOYSA-N
XLogP3.66
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.53
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-azabicyclo[4.3.1]decan-3-yl)-3-pyridinyl]-2-(2-azabicyclo[2.2.2]octan-2-yl)acetamide
CID 167176056
2-(2-azabicyclo[2.2.2]octan-2-yl)-N-[6-(azepan-1-yl)-3-pyridinyl]acetamide
CID 155402749
2-(2-azabicyclo[2.2.2]octan-2-yl)-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]acetamide
CID 155402796
2-(8-azabicyclo[3.2.1]octan-8-yl)-N-[4-(azepan-1-yl)phenyl]acetamide
CID 166024724
2-(4-cyclobutyl-6-methyl-1,4-diazepan-1-yl)-N-(6-piperidin-1-yl-3-pyridinyl)acetamide
CID 136544531
N-[6-(azepan-1-yl)-3-pyridinyl]-2-piperidin-1-ylacetamide
CID 155391895
N-[6-(4-cyclopentylpiperazin-1-yl)-3-pyridinyl]butanamide
CID 11623843
N-[6-(azepan-1-yl)-3-pyridinyl]-2-(cyclohexylamino)acetamide
CID 155391840
N-[6-(azepan-1-yl)-3-pyridinyl]-2-(cycloheptylamino)acetamide
CID 155391842
2-amino-N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]acetamide
CID 82034957
2-cyclopent-2-en-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
CID 43041645
2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]acetamide
CID 98764784

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide?
The IUPAC name of N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide (CID 166024726) is N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide.
What is the SMILES notation for N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide?
The canonical SMILES for N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide is O=C(CN1C2CCCC1CC2)Nc1ccc(N2CC3CCC(CC3)C2)nc1.
What is the InChIKey of N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide?
The InChIKey is UJGJYJAGLULXSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N4O/c27-22(15-26-19-2-1-3-20(26)10-9-19)24-18-8-11-21(23-12-18)25-13-16-4-5-17(14-25)7-6-16/h8,11-12,16-17,19-20H,1-7,9-10,13-15H2,(H,24,27).
What are the key properties of N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide?
N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide has a molecular weight of 368.53 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-azabicyclo[3.2.2]nonan-3-yl)-3-pyridinyl]-2-(8-azabicyclo[3.2.1]octan-8-yl)acetamide is sourced from PubChem (CID 166024726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).