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

C14H23N3O3 — CID 126438337

IUPAC(2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide
SMILESCC(C)c1nc(CCN(C)C(=O)[C@@]2(C)CCCO2)no1
InChIInChI=1S/C14H23N3O3/c1-10(2)12-15-11(16-20-12)6-8-17(4)13(18)14(3)7-5-9-19-14/h10H,5-9H2,1-4H3/t14-/m1/s1
InChIKeyAXPKEGOEEZYSFL-CQSZACIVSA-N
MW281.36 g/mol
LogP1.76
Rot. Bonds5

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

(2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide (PubChem CID 126438337) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide
PubChem CID126438337
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name(2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide
SMILESCC(C)c1nc(CCN(C)C(=O)[C@@]2(C)CCCO2)no1
InChIInChI=1S/C14H23N3O3/c1-10(2)12-15-11(16-20-12)6-8-17(4)13(18)14(3)7-5-9-19-14/h10H,5-9H2,1-4H3/t14-/m1/s1
InChIKeyAXPKEGOEEZYSFL-CQSZACIVSA-N
XLogP1.76
TPSA68.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide (CID 126438337) is (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide is CC(C)c1nc(CCN(C)C(=O)[C@@]2(C)CCCO2)no1.
What is the InChIKey of (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide?
The InChIKey is AXPKEGOEEZYSFL-CQSZACIVSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-10(2)12-15-11(16-20-12)6-8-17(4)13(18)14(3)7-5-9-19-14/h10H,5-9H2,1-4H3/t14-/m1/s1.
What are the key properties of (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide?
(2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 1.76, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,2-dimethyl-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 126438337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).