2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

C20H27N3O3 — CID 119703964

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
SMILESO=C(CC1CC2CCC(C1)N2)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C20H27N3O3/c24-19(13-14-11-15-5-6-16(12-14)21-15)22-18-4-2-1-3-17(18)20(25)23-7-9-26-10-8-23/h1-4,14-16,21H,5-13H2,(H,22,24)
InChIKeyWYXUWHSUQIQIAU-UHFFFAOYSA-N
MW357.45 g/mol
LogP2.02
Rot. Bonds4

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 119703964) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID119703964
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
SMILESO=C(CC1CC2CCC(C1)N2)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C20H27N3O3/c24-19(13-14-11-15-5-6-16(12-14)21-15)22-18-4-2-1-3-17(18)20(25)23-7-9-26-10-8-23/h1-4,14-16,21H,5-13H2,(H,22,24)
InChIKeyWYXUWHSUQIQIAU-UHFFFAOYSA-N
XLogP2.02
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide (CID 119703964) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide is O=C(CC1CC2CCC(C1)N2)Nc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is WYXUWHSUQIQIAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c24-19(13-14-11-15-5-6-16(12-14)21-15)22-18-4-2-1-3-17(18)20(25)23-7-9-26-10-8-23/h1-4,14-16,21H,5-13H2,(H,22,24).
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 357.45 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 119703964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).