2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine

C20H20N4O2 — CID 133347022

IUPAC2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine
SMILESc1coc(C2CN(c3nc(-c4ccncc4)nc4c3CCC4)CCO2)c1
InChIInChI=1S/C20H20N4O2/c1-3-15-16(4-1)22-19(14-6-8-21-9-7-14)23-20(15)24-10-12-26-18(13-24)17-5-2-11-25-17/h2,5-9,11,18H,1,3-4,10,12-13H2
InChIKeyRYHIZXYXZIDCJH-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.20
Rot. Bonds3

About 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine

2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine (PubChem CID 133347022) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine
PubChem CID133347022
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC Name2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine
SMILESc1coc(C2CN(c3nc(-c4ccncc4)nc4c3CCC4)CCO2)c1
InChIInChI=1S/C20H20N4O2/c1-3-15-16(4-1)22-19(14-6-8-21-9-7-14)23-20(15)24-10-12-26-18(13-24)17-5-2-11-25-17/h2,5-9,11,18H,1,3-4,10,12-13H2
InChIKeyRYHIZXYXZIDCJH-UHFFFAOYSA-N
XLogP3.20
TPSA64.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine?
The IUPAC name of 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine (CID 133347022) is 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine is c1coc(C2CN(c3nc(-c4ccncc4)nc4c3CCC4)CCO2)c1.
What is the InChIKey of 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine?
The InChIKey is RYHIZXYXZIDCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-3-15-16(4-1)22-19(14-6-8-21-9-7-14)23-20(15)24-10-12-26-18(13-24)17-5-2-11-25-17/h2,5-9,11,18H,1,3-4,10,12-13H2.
What are the key properties of 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine?
2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine has a molecular weight of 348.41 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 133347022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).