(2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide

C11H15N3O5 — CID 136581966

IUPAC(2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide
SMILESCOc1cc(C(=O)N2CCO[C@H](C)[C@H]2C(N)=O)on1
InChIInChI=1S/C11H15N3O5/c1-6-9(10(12)15)14(3-4-18-6)11(16)7-5-8(17-2)13-19-7/h5-6,9H,3-4H2,1-2H3,(H2,12,15)/t6-,9+/m1/s1
InChIKeyYSSRZHPWHHLGPV-MUWHJKNJSA-N
MW269.26 g/mol
LogP-0.60
Rot. Bonds3

About (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide

(2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide (PubChem CID 136581966) has the molecular formula C11H15N3O5 and a molecular weight of 269.26 g/mol. Its IUPAC name is (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide
PubChem CID136581966
Molecular FormulaC11H15N3O5
Molecular Weight269.26 g/mol
Exact Mass269.10
IUPAC Name(2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide
SMILESCOc1cc(C(=O)N2CCO[C@H](C)[C@H]2C(N)=O)on1
InChIInChI=1S/C11H15N3O5/c1-6-9(10(12)15)14(3-4-18-6)11(16)7-5-8(17-2)13-19-7/h5-6,9H,3-4H2,1-2H3,(H2,12,15)/t6-,9+/m1/s1
InChIKeyYSSRZHPWHHLGPV-MUWHJKNJSA-N
XLogP-0.60
TPSA107.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide?
The IUPAC name of (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide (CID 136581966) is (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide.
What is the SMILES notation for (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide?
The canonical SMILES for (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide is COc1cc(C(=O)N2CCO[C@H](C)[C@H]2C(N)=O)on1.
What is the InChIKey of (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide?
The InChIKey is YSSRZHPWHHLGPV-MUWHJKNJSA-N. The full InChI is InChI=1S/C11H15N3O5/c1-6-9(10(12)15)14(3-4-18-6)11(16)7-5-8(17-2)13-19-7/h5-6,9H,3-4H2,1-2H3,(H2,12,15)/t6-,9+/m1/s1.
What are the key properties of (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide?
(2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide has a molecular weight of 269.26 g/mol, XLogP of -0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-4-(3-methoxy-1,2-oxazole-5-carbonyl)-2-methylmorpholine-3-carboxamide is sourced from PubChem (CID 136581966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).