4-(3-pyrimidin-4-ylpropyl)morpholine

C11H17N3O — CID 170871346

IUPAC4-(3-pyrimidin-4-ylpropyl)morpholine
SMILESc1cc(CCCN2CCOCC2)ncn1
InChIInChI=1S/C11H17N3O/c1(2-11-3-4-12-10-13-11)5-14-6-8-15-9-7-14/h3-4,10H,1-2,5-9H2
InChIKeyQLCRYDPAOMBMSV-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.74
Rot. Bonds4

About 4-(3-pyrimidin-4-ylpropyl)morpholine

4-(3-pyrimidin-4-ylpropyl)morpholine (PubChem CID 170871346) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-(3-pyrimidin-4-ylpropyl)morpholine.

Molecular Properties

Compound Name4-(3-pyrimidin-4-ylpropyl)morpholine
PubChem CID170871346
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name4-(3-pyrimidin-4-ylpropyl)morpholine
SMILESc1cc(CCCN2CCOCC2)ncn1
InChIInChI=1S/C11H17N3O/c1(2-11-3-4-12-10-13-11)5-14-6-8-15-9-7-14/h3-4,10H,1-2,5-9H2
InChIKeyQLCRYDPAOMBMSV-UHFFFAOYSA-N
XLogP0.74
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-pyrimidin-2-ylpropyl)morpholine
CID 170871392
N-(3-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
CID 141309481
4-[3-(3-bromo-2-pyridinyl)propyl]morpholine
CID 170871440
4-[3-(4,6-dichloropyrimidin-5-yl)propyl]morpholine
CID 170871352
3-morpholin-4-yl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 60649527
4-(3-isoquinolin-8-ylpropyl)morpholine
CID 170870005
4-[3-(4-ethynyl-3-pyridinyl)propyl]morpholine
CID 142566582
4-[3-(1H-pyrazol-5-yl)propyl]morpholine
CID 67651050
4-(3-quinoxalin-6-ylpropyl)morpholine
CID 170869858
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
6-(pyrimidin-4-ylmethyl)-4-(3,3,3-trifluoropropyl)-1,4-oxazepane
CID 110115259
4-[3-(4-iodophenyl)propyl]morpholine
CID 143873101

Frequently Asked Questions

What is the IUPAC name of 4-(3-pyrimidin-4-ylpropyl)morpholine?
The IUPAC name of 4-(3-pyrimidin-4-ylpropyl)morpholine (CID 170871346) is 4-(3-pyrimidin-4-ylpropyl)morpholine.
What is the SMILES notation for 4-(3-pyrimidin-4-ylpropyl)morpholine?
The canonical SMILES for 4-(3-pyrimidin-4-ylpropyl)morpholine is c1cc(CCCN2CCOCC2)ncn1.
What is the InChIKey of 4-(3-pyrimidin-4-ylpropyl)morpholine?
The InChIKey is QLCRYDPAOMBMSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1(2-11-3-4-12-10-13-11)5-14-6-8-15-9-7-14/h3-4,10H,1-2,5-9H2.
What are the key properties of 4-(3-pyrimidin-4-ylpropyl)morpholine?
4-(3-pyrimidin-4-ylpropyl)morpholine has a molecular weight of 207.28 g/mol, XLogP of 0.74, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-pyrimidin-4-ylpropyl)morpholine is sourced from PubChem (CID 170871346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).