(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide

C15H23N3O3 — CID 128978878

IUPAC(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
SMILESCc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)on1
InChIInChI=1S/C15H23N3O3/c1-10-8-12(21-17-10)9-18-5-2-11(3-6-18)14-13(15(16)19)4-7-20-14/h8,11,13-14H,2-7,9H2,1H3,(H2,16,19)/t13-,14+/m0/s1
InChIKeyWMDRBESEOPSBBV-UONOGXRCSA-N
MW293.37 g/mol
LogP1.09
Rot. Bonds4

About (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide

(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide (PubChem CID 128978878) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
PubChem CID128978878
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
SMILESCc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)on1
InChIInChI=1S/C15H23N3O3/c1-10-8-12(21-17-10)9-18-5-2-11(3-6-18)14-13(15(16)19)4-7-20-14/h8,11,13-14H,2-7,9H2,1H3,(H2,16,19)/t13-,14+/m0/s1
InChIKeyWMDRBESEOPSBBV-UONOGXRCSA-N
XLogP1.09
TPSA81.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
The IUPAC name of (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide (CID 128978878) is (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide.
What is the SMILES notation for (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
The canonical SMILES for (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide is Cc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)on1.
What is the InChIKey of (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
The InChIKey is WMDRBESEOPSBBV-UONOGXRCSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-10-8-12(21-17-10)9-18-5-2-11(3-6-18)14-13(15(16)19)4-7-20-14/h8,11,13-14H,2-7,9H2,1H3,(H2,16,19)/t13-,14+/m0/s1.
What are the key properties of (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide is sourced from PubChem (CID 128978878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).