4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine

C12H18N4O — CID 75485556

IUPAC4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine
SMILESc1cc(C2CCCN2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H18N4O/c1-2-10(13-4-1)11-3-5-14-12(15-11)16-6-8-17-9-7-16/h3,5,10,13H,1-2,4,6-9H2
InChIKeyFQTKCSGTXZTWBK-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.74
Rot. Bonds2

About 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine

4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine (PubChem CID 75485556) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine
PubChem CID75485556
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine
SMILESc1cc(C2CCCN2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H18N4O/c1-2-10(13-4-1)11-3-5-14-12(15-11)16-6-8-17-9-7-16/h3,5,10,13H,1-2,4,6-9H2
InChIKeyFQTKCSGTXZTWBK-UHFFFAOYSA-N
XLogP0.74
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[6-[(2R)-pyrrolidin-2-yl]-2-pyridinyl]-1,4-oxazepane
CID 95846671
4-pyrrolidin-2-ylpyrimidin-2-amine
CID 53408029
4-(4-piperidin-2-yl-8,9,10,11-tetrahydro-5H-1,5,6-benzotriazonin-7-yl)morpholine
CID 163559619
4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine
CID 112884623
4-[2-[(2R)-pyrrolidin-2-yl]phenyl]morpholine
CID 96807241
4-[4-(chloromethyl)pyrimidin-2-yl]morpholine
CID 62747047
N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide
CID 167035052
4-(4-thiophen-2-ylpyrimidin-2-yl)morpholine
CID 66493934
4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine
CID 121406375
2-[5-pyrrolidin-2-yl-4-(2-pyrrolidin-1-ylpyrimidin-4-yl)pyrazol-1-yl]ethanol
CID 175662113
N-methyl-4-[(2S)-piperidin-2-yl]pyrimidin-2-amine
CID 95827769
2-[(2R)-pyrrolidin-2-yl]pyridine
CID 7141590

Frequently Asked Questions

What is the IUPAC name of 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine?
The IUPAC name of 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine (CID 75485556) is 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine.
What is the SMILES notation for 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine?
The canonical SMILES for 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine is c1cc(C2CCCN2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine?
The InChIKey is FQTKCSGTXZTWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-2-10(13-4-1)11-3-5-14-12(15-11)16-6-8-17-9-7-16/h3,5,10,13H,1-2,4,6-9H2.
What are the key properties of 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine?
4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine has a molecular weight of 234.30 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine is sourced from PubChem (CID 75485556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).