4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine

C16H26N4O — CID 114739493

IUPAC4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
SMILESCCCc1nc(C2CN(CC)CCO2)nc2c1CNCC2
InChIInChI=1S/C16H26N4O/c1-3-5-13-12-10-17-7-6-14(12)19-16(18-13)15-11-20(4-2)8-9-21-15/h15,17H,3-11H2,1-2H3
InChIKeyJPZLAURNWUIKSG-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.47
Rot. Bonds4

About 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine

4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine (PubChem CID 114739493) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
PubChem CID114739493
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
SMILESCCCc1nc(C2CN(CC)CCO2)nc2c1CNCC2
InChIInChI=1S/C16H26N4O/c1-3-5-13-12-10-17-7-6-14(12)19-16(18-13)15-11-20(4-2)8-9-21-15/h15,17H,3-11H2,1-2H3
InChIKeyJPZLAURNWUIKSG-UHFFFAOYSA-N
XLogP1.47
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
The IUPAC name of 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine (CID 114739493) is 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine.
What is the SMILES notation for 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
The canonical SMILES for 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine is CCCc1nc(C2CN(CC)CCO2)nc2c1CNCC2.
What is the InChIKey of 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
The InChIKey is JPZLAURNWUIKSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-5-13-12-10-17-7-6-14(12)19-16(18-13)15-11-20(4-2)8-9-21-15/h15,17H,3-11H2,1-2H3.
What are the key properties of 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine has a molecular weight of 290.41 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine is sourced from PubChem (CID 114739493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).