5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide

C15H22N2O3 — CID 125143726

IUPAC5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide
SMILESCC1(C)C[C@H](NC(=O)c2ncoc2C2CC2)C(C)(C)O1
InChIInChI=1S/C15H22N2O3/c1-14(2)7-10(15(3,4)20-14)17-13(18)11-12(9-5-6-9)19-8-16-11/h8-10H,5-7H2,1-4H3,(H,17,18)/t10-/m0/s1
InChIKeyRIAVUKCEBZMFST-JTQLQIEISA-N
MW278.35 g/mol
LogP2.63
Rot. Bonds3

About 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide

5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide (PubChem CID 125143726) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide
PubChem CID125143726
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide
SMILESCC1(C)C[C@H](NC(=O)c2ncoc2C2CC2)C(C)(C)O1
InChIInChI=1S/C15H22N2O3/c1-14(2)7-10(15(3,4)20-14)17-13(18)11-12(9-5-6-9)19-8-16-11/h8-10H,5-7H2,1-4H3,(H,17,18)/t10-/m0/s1
InChIKeyRIAVUKCEBZMFST-JTQLQIEISA-N
XLogP2.63
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide (CID 125143726) is 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide is CC1(C)C[C@H](NC(=O)c2ncoc2C2CC2)C(C)(C)O1.
What is the InChIKey of 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide?
The InChIKey is RIAVUKCEBZMFST-JTQLQIEISA-N. The full InChI is InChI=1S/C15H22N2O3/c1-14(2)7-10(15(3,4)20-14)17-13(18)11-12(9-5-6-9)19-8-16-11/h8-10H,5-7H2,1-4H3,(H,17,18)/t10-/m0/s1.
What are the key properties of 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide?
5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(3S)-2,2,5,5-tetramethyloxolan-3-yl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 125143726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).