3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide

C19H25N3O3 — CID 35161959

IUPAC3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)NCCN3CCOCC3)o2)cc1
InChIInChI=1S/C19H25N3O3/c1-15-2-4-16(5-3-15)17-14-21-19(25-17)7-6-18(23)20-8-9-22-10-12-24-13-11-22/h2-5,14H,6-13H2,1H3,(H,20,23)
InChIKeyIFNCJRQNJIPDNZ-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.03
Rot. Bonds7

About 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide

3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 35161959) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID35161959
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)NCCN3CCOCC3)o2)cc1
InChIInChI=1S/C19H25N3O3/c1-15-2-4-16(5-3-15)17-14-21-19(25-17)7-6-18(23)20-8-9-22-10-12-24-13-11-22/h2-5,14H,6-13H2,1H3,(H,20,23)
InChIKeyIFNCJRQNJIPDNZ-UHFFFAOYSA-N
XLogP2.03
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide (CID 35161959) is 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide is Cc1ccc(-c2cnc(CCC(=O)NCCN3CCOCC3)o2)cc1.
What is the InChIKey of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is IFNCJRQNJIPDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-15-2-4-16(5-3-15)17-14-21-19(25-17)7-6-18(23)20-8-9-22-10-12-24-13-11-22/h2-5,14H,6-13H2,1H3,(H,20,23).
What are the key properties of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide?
3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 343.43 g/mol, XLogP of 2.03, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 35161959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).