(2R,5R)-5-methoxyoxane-2-carboxamide

C7H13NO3 — CID 173141169

IUPAC(2R,5R)-5-methoxyoxane-2-carboxamide
SMILESCO[C@@H]1CC[C@H](C(N)=O)OC1
InChIInChI=1S/C7H13NO3/c1-10-5-2-3-6(7(8)9)11-4-5/h5-6H,2-4H2,1H3,(H2,8,9)/t5-,6-/m1/s1
InChIKeySYVHWLIRESEDQQ-PHDIDXHHSA-N
MW159.18 g/mol
LogP-0.33
Rot. Bonds2

About (2R,5R)-5-methoxyoxane-2-carboxamide

(2R,5R)-5-methoxyoxane-2-carboxamide (PubChem CID 173141169) has the molecular formula C7H13NO3 and a molecular weight of 159.18 g/mol. Its IUPAC name is (2R,5R)-5-methoxyoxane-2-carboxamide.

Molecular Properties

Compound Name(2R,5R)-5-methoxyoxane-2-carboxamide
PubChem CID173141169
Molecular FormulaC7H13NO3
Molecular Weight159.18 g/mol
Exact Mass159.09
IUPAC Name(2R,5R)-5-methoxyoxane-2-carboxamide
SMILESCO[C@@H]1CC[C@H](C(N)=O)OC1
InChIInChI=1S/C7H13NO3/c1-10-5-2-3-6(7(8)9)11-4-5/h5-6H,2-4H2,1H3,(H2,8,9)/t5-,6-/m1/s1
InChIKeySYVHWLIRESEDQQ-PHDIDXHHSA-N
XLogP-0.33
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.18
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-5-methoxyoxane-2-carboxamide?
The IUPAC name of (2R,5R)-5-methoxyoxane-2-carboxamide (CID 173141169) is (2R,5R)-5-methoxyoxane-2-carboxamide.
What is the SMILES notation for (2R,5R)-5-methoxyoxane-2-carboxamide?
The canonical SMILES for (2R,5R)-5-methoxyoxane-2-carboxamide is CO[C@@H]1CC[C@H](C(N)=O)OC1.
What is the InChIKey of (2R,5R)-5-methoxyoxane-2-carboxamide?
The InChIKey is SYVHWLIRESEDQQ-PHDIDXHHSA-N. The full InChI is InChI=1S/C7H13NO3/c1-10-5-2-3-6(7(8)9)11-4-5/h5-6H,2-4H2,1H3,(H2,8,9)/t5-,6-/m1/s1.
What are the key properties of (2R,5R)-5-methoxyoxane-2-carboxamide?
(2R,5R)-5-methoxyoxane-2-carboxamide has a molecular weight of 159.18 g/mol, XLogP of -0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-5-methoxyoxane-2-carboxamide is sourced from PubChem (CID 173141169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).