N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide

C13H18N4O3 — CID 71789988

IUPACN-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide
SMILESO=C(Nc1cnc(N2CCOCC2)nc1)C1CCCO1
InChIInChI=1S/C13H18N4O3/c18-12(11-2-1-5-20-11)16-10-8-14-13(15-9-10)17-3-6-19-7-4-17/h8-9,11H,1-7H2,(H,16,18)
InChIKeyZHWUOQAVPHWRJI-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.43
Rot. Bonds3

About N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide

N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide (PubChem CID 71789988) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide
PubChem CID71789988
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC NameN-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide
SMILESO=C(Nc1cnc(N2CCOCC2)nc1)C1CCCO1
InChIInChI=1S/C13H18N4O3/c18-12(11-2-1-5-20-11)16-10-8-14-13(15-9-10)17-3-6-19-7-4-17/h8-9,11H,1-7H2,(H,16,18)
InChIKeyZHWUOQAVPHWRJI-UHFFFAOYSA-N
XLogP0.43
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide (CID 71789988) is N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide is O=C(Nc1cnc(N2CCOCC2)nc1)C1CCCO1.
What is the InChIKey of N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide?
The InChIKey is ZHWUOQAVPHWRJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O3/c18-12(11-2-1-5-20-11)16-10-8-14-13(15-9-10)17-3-6-19-7-4-17/h8-9,11H,1-7H2,(H,16,18).
What are the key properties of N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide?
N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylpyrimidin-5-yl)oxolane-2-carboxamide is sourced from PubChem (CID 71789988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).