2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide

C11H11ClN4O3 — CID 86618417

IUPAC2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
SMILESNC(=O)c1cc2nc(Cl)nc(N3CCOCC3)c2o1
InChIInChI=1S/C11H11ClN4O3/c12-11-14-6-5-7(9(13)17)19-8(6)10(15-11)16-1-3-18-4-2-16/h5H,1-4H2,(H2,13,17)
InChIKeyFOGYOODMKXWFHA-UHFFFAOYSA-N
MW282.69 g/mol
LogP0.81
Rot. Bonds2

About 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide

2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide (PubChem CID 86618417) has the molecular formula C11H11ClN4O3 and a molecular weight of 282.69 g/mol. Its IUPAC name is 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
PubChem CID86618417
Molecular FormulaC11H11ClN4O3
Molecular Weight282.69 g/mol
Exact Mass282.05
IUPAC Name2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
SMILESNC(=O)c1cc2nc(Cl)nc(N3CCOCC3)c2o1
InChIInChI=1S/C11H11ClN4O3/c12-11-14-6-5-7(9(13)17)19-8(6)10(15-11)16-1-3-18-4-2-16/h5H,1-4H2,(H2,13,17)
InChIKeyFOGYOODMKXWFHA-UHFFFAOYSA-N
XLogP0.81
TPSA94.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.69
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide?
The IUPAC name of 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide (CID 86618417) is 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide?
The canonical SMILES for 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide is NC(=O)c1cc2nc(Cl)nc(N3CCOCC3)c2o1.
What is the InChIKey of 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide?
The InChIKey is FOGYOODMKXWFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4O3/c12-11-14-6-5-7(9(13)17)19-8(6)10(15-11)16-1-3-18-4-2-16/h5H,1-4H2,(H2,13,17).
What are the key properties of 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide?
2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide has a molecular weight of 282.69 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 86618417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).