N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide

C24H28N2O4 — CID 133199217

IUPACN-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
SMILESCC(Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C24H28N2O4/c1-17(30-20-11-10-18-6-2-3-7-19(18)16-20)23(27)25-22-9-5-4-8-21(22)24(28)26-12-14-29-15-13-26/h4-5,8-11,16-17H,2-3,6-7,12-15H2,1H3,(H,25,27)
InChIKeyOBRYZOCHURJCKU-UHFFFAOYSA-N
MW408.50 g/mol
LogP3.44
Rot. Bonds5

About N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide

N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide (PubChem CID 133199217) has the molecular formula C24H28N2O4 and a molecular weight of 408.50 g/mol. Its IUPAC name is N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide.

Molecular Properties

Compound NameN-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
PubChem CID133199217
Molecular FormulaC24H28N2O4
Molecular Weight408.50 g/mol
Exact Mass408.20
IUPAC NameN-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
SMILESCC(Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C24H28N2O4/c1-17(30-20-11-10-18-6-2-3-7-19(18)16-20)23(27)25-22-9-5-4-8-21(22)24(28)26-12-14-29-15-13-26/h4-5,8-11,16-17H,2-3,6-7,12-15H2,1H3,(H,25,27)
InChIKeyOBRYZOCHURJCKU-UHFFFAOYSA-N
XLogP3.44
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.50
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide?
The IUPAC name of N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide (CID 133199217) is N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide.
What is the SMILES notation for N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide?
The canonical SMILES for N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide is CC(Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide?
The InChIKey is OBRYZOCHURJCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O4/c1-17(30-20-11-10-18-6-2-3-7-19(18)16-20)23(27)25-22-9-5-4-8-21(22)24(28)26-12-14-29-15-13-26/h4-5,8-11,16-17H,2-3,6-7,12-15H2,1H3,(H,25,27).
What are the key properties of N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide?
N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide has a molecular weight of 408.50 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(morpholine-4-carbonyl)phenyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide is sourced from PubChem (CID 133199217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).