(2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide

C15H24N4O4 — CID 124971497

IUPAC(2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide
SMILESCNC(=O)[C@@]1(C)CN(C(=O)CCc2nnc(C(C)C)o2)CCO1
InChIInChI=1S/C15H24N4O4/c1-10(2)13-18-17-11(23-13)5-6-12(20)19-7-8-22-15(3,9-19)14(21)16-4/h10H,5-9H2,1-4H3,(H,16,21)/t15-/m1/s1
InChIKeyJWXMVBPTVONIMP-OAHLLOKOSA-N
MW324.38 g/mol
LogP0.49
Rot. Bonds5

About (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide

(2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide (PubChem CID 124971497) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide
PubChem CID124971497
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Name(2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide
SMILESCNC(=O)[C@@]1(C)CN(C(=O)CCc2nnc(C(C)C)o2)CCO1
InChIInChI=1S/C15H24N4O4/c1-10(2)13-18-17-11(23-13)5-6-12(20)19-7-8-22-15(3,9-19)14(21)16-4/h10H,5-9H2,1-4H3,(H,16,21)/t15-/m1/s1
InChIKeyJWXMVBPTVONIMP-OAHLLOKOSA-N
XLogP0.49
TPSA97.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide?
The IUPAC name of (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide (CID 124971497) is (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide.
What is the SMILES notation for (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide?
The canonical SMILES for (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide is CNC(=O)[C@@]1(C)CN(C(=O)CCc2nnc(C(C)C)o2)CCO1.
What is the InChIKey of (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide?
The InChIKey is JWXMVBPTVONIMP-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H24N4O4/c1-10(2)13-18-17-11(23-13)5-6-12(20)19-7-8-22-15(3,9-19)14(21)16-4/h10H,5-9H2,1-4H3,(H,16,21)/t15-/m1/s1.
What are the key properties of (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide?
(2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 0.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,2-dimethyl-4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]morpholine-2-carboxamide is sourced from PubChem (CID 124971497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).