N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide

C14H23N3O3 — CID 162645163

IUPACN-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide
SMILESCC(C)(C)c1cc(NC(=O)CCN2CCOCC2)no1
InChIInChI=1S/C14H23N3O3/c1-14(2,3)11-10-12(16-20-11)15-13(18)4-5-17-6-8-19-9-7-17/h10H,4-9H2,1-3H3,(H,15,16,18)
InChIKeyOTQPBRLDNFIOIZ-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.63
Rot. Bonds4

About N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide

N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide (PubChem CID 162645163) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide
PubChem CID162645163
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC NameN-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide
SMILESCC(C)(C)c1cc(NC(=O)CCN2CCOCC2)no1
InChIInChI=1S/C14H23N3O3/c1-14(2,3)11-10-12(16-20-11)15-13(18)4-5-17-6-8-19-9-7-17/h10H,4-9H2,1-3H3,(H,15,16,18)
InChIKeyOTQPBRLDNFIOIZ-UHFFFAOYSA-N
XLogP1.63
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide?
The IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide (CID 162645163) is N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide is CC(C)(C)c1cc(NC(=O)CCN2CCOCC2)no1.
What is the InChIKey of N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide?
The InChIKey is OTQPBRLDNFIOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-14(2,3)11-10-12(16-20-11)15-13(18)4-5-17-6-8-19-9-7-17/h10H,4-9H2,1-3H3,(H,15,16,18).
What are the key properties of N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide?
N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide has a molecular weight of 281.36 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1,2-oxazol-3-yl)-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 162645163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).