(2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide

C14H26N2O3 — CID 100836848

IUPAC(2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide
SMILESC[C@@H]1CN([C@H](C)CNC(=O)[C@H]2CCCO2)C[C@H](C)O1
InChIInChI=1S/C14H26N2O3/c1-10(16-8-11(2)19-12(3)9-16)7-15-14(17)13-5-4-6-18-13/h10-13H,4-9H2,1-3H3,(H,15,17)/t10-,11-,12+,13-/m1/s1
InChIKeyIJUMMMLZFSZDTC-FVCCEPFGSA-N
MW270.37 g/mol
LogP0.78
Rot. Bonds4

About (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide

(2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide (PubChem CID 100836848) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide
PubChem CID100836848
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name(2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide
SMILESC[C@@H]1CN([C@H](C)CNC(=O)[C@H]2CCCO2)C[C@H](C)O1
InChIInChI=1S/C14H26N2O3/c1-10(16-8-11(2)19-12(3)9-16)7-15-14(17)13-5-4-6-18-13/h10-13H,4-9H2,1-3H3,(H,15,17)/t10-,11-,12+,13-/m1/s1
InChIKeyIJUMMMLZFSZDTC-FVCCEPFGSA-N
XLogP0.78
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide (CID 100836848) is (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide is C[C@@H]1CN([C@H](C)CNC(=O)[C@H]2CCCO2)C[C@H](C)O1.
What is the InChIKey of (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide?
The InChIKey is IJUMMMLZFSZDTC-FVCCEPFGSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-10(16-8-11(2)19-12(3)9-16)7-15-14(17)13-5-4-6-18-13/h10-13H,4-9H2,1-3H3,(H,15,17)/t10-,11-,12+,13-/m1/s1.
What are the key properties of (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide?
(2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propyl]oxolane-2-carboxamide is sourced from PubChem (CID 100836848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).