2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine

C15H22N4O — CID 114739733

IUPAC2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine
SMILESCCN1CCOC(c2nc3c(c(C4CC4)n2)CNC3)C1
InChIInChI=1S/C15H22N4O/c1-2-19-5-6-20-13(9-19)15-17-12-8-16-7-11(12)14(18-15)10-3-4-10/h10,13,16H,2-9H2,1H3
InChIKeyQJDQUJVQOMMBFP-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.35
Rot. Bonds3

About 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine

2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine (PubChem CID 114739733) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine.

Molecular Properties

Compound Name2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine
PubChem CID114739733
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine
SMILESCCN1CCOC(c2nc3c(c(C4CC4)n2)CNC3)C1
InChIInChI=1S/C15H22N4O/c1-2-19-5-6-20-13(9-19)15-17-12-8-16-7-11(12)14(18-15)10-3-4-10/h10,13,16H,2-9H2,1H3
InChIKeyQJDQUJVQOMMBFP-UHFFFAOYSA-N
XLogP1.35
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethyl-2-[4-(trifluoromethyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl]morpholine
CID 114739930
4-ethyl-2-(4-ethyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
CID 114738606
4-ethyl-2-(4-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
CID 114739493
6-cyclopropyl-2-(4-ethylmorpholin-2-yl)-N-methylpyrimidin-4-amine
CID 79669667
2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine
CID 79666573
2-cyclooctyl-4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114739789
4-ethyl-2-(5-pyrrolidin-3-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 79666239
2-(5-bromo-4-chloro-6-cyclopropylpyrimidin-2-yl)-4-propylmorpholine
CID 79669077
4-cyclopropyl-2-(4-propan-2-ylcyclohexyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114739633
[2-(4-ethylmorpholin-2-yl)-4,6-dimethylpyrimidin-5-yl]methanamine
CID 79669278
2-(4-ethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-yl)-4-propan-2-ylmorpholine
CID 114742471
[4-cyclopropyl-2-(4-ethylmorpholin-2-yl)-1,3-thiazol-5-yl]methanamine
CID 114361926

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine?
The IUPAC name of 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine (CID 114739733) is 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine.
What is the SMILES notation for 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine?
The canonical SMILES for 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine is CCN1CCOC(c2nc3c(c(C4CC4)n2)CNC3)C1.
What is the InChIKey of 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine?
The InChIKey is QJDQUJVQOMMBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-2-19-5-6-20-13(9-19)15-17-12-8-16-7-11(12)14(18-15)10-3-4-10/h10,13,16H,2-9H2,1H3.
What are the key properties of 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine?
2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine has a molecular weight of 274.37 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)-4-ethylmorpholine is sourced from PubChem (CID 114739733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).