(5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone

C16H26N2O3 — CID 45193950

IUPAC(5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone
SMILESCCc1ocnc1C(=O)N1CCOC(CCCC(C)C)C1
InChIInChI=1S/C16H26N2O3/c1-4-14-15(17-11-21-14)16(19)18-8-9-20-13(10-18)7-5-6-12(2)3/h11-13H,4-10H2,1-3H3
InChIKeySJQBKMSARRFEIQ-UHFFFAOYSA-N
MW294.39 g/mol
LogP2.90
Rot. Bonds6

About (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone

(5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone (PubChem CID 45193950) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone
PubChem CID45193950
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name(5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone
SMILESCCc1ocnc1C(=O)N1CCOC(CCCC(C)C)C1
InChIInChI=1S/C16H26N2O3/c1-4-14-15(17-11-21-14)16(19)18-8-9-20-13(10-18)7-5-6-12(2)3/h11-13H,4-10H2,1-3H3
InChIKeySJQBKMSARRFEIQ-UHFFFAOYSA-N
XLogP2.90
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone?
The IUPAC name of (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone (CID 45193950) is (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone.
What is the SMILES notation for (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone?
The canonical SMILES for (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone is CCc1ocnc1C(=O)N1CCOC(CCCC(C)C)C1.
What is the InChIKey of (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone?
The InChIKey is SJQBKMSARRFEIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-4-14-15(17-11-21-14)16(19)18-8-9-20-13(10-18)7-5-6-12(2)3/h11-13H,4-10H2,1-3H3.
What are the key properties of (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone?
(5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone has a molecular weight of 294.39 g/mol, XLogP of 2.90, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-1,3-oxazol-4-yl)-[2-(4-methylpentyl)morpholin-4-yl]methanone is sourced from PubChem (CID 45193950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).