4-(6-cyclobutylpyrimidin-4-yl)morpholine

C12H17N3O — CID 119103444

IUPAC4-(6-cyclobutylpyrimidin-4-yl)morpholine
SMILESc1nc(C2CCC2)cc(N2CCOCC2)n1
InChIInChI=1S/C12H17N3O/c1-2-10(3-1)11-8-12(14-9-13-11)15-4-6-16-7-5-15/h8-10H,1-7H2
InChIKeyNKLULUSYYZLCHE-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.58
Rot. Bonds2

About 4-(6-cyclobutylpyrimidin-4-yl)morpholine

4-(6-cyclobutylpyrimidin-4-yl)morpholine (PubChem CID 119103444) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 4-(6-cyclobutylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(6-cyclobutylpyrimidin-4-yl)morpholine
PubChem CID119103444
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name4-(6-cyclobutylpyrimidin-4-yl)morpholine
SMILESc1nc(C2CCC2)cc(N2CCOCC2)n1
InChIInChI=1S/C12H17N3O/c1-2-10(3-1)11-8-12(14-9-13-11)15-4-6-16-7-5-15/h8-10H,1-7H2
InChIKeyNKLULUSYYZLCHE-UHFFFAOYSA-N
XLogP1.58
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

cis-3-{6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl}cyclobutanol
CID 91770488
N,N-dimethyl-6-[(1-methylpiperidin-3-yl)methyl]pyrimidin-4-amine
CID 90054668
N-(tert-butyl)-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine
CID 50977646
4-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine
CID 53192873
4-cyclobutyl-6-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine
CID 56869819
(2S)-2-methyl-3-{4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperidinyl}-1-propanol
CID 56914426
6-isopropyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pyrimidin-4-amine
CID 72851576
4-[3-(2-Methylpyrimidin-4-YL)piperidin-1-ylsulfonyl]morpholine
CID 110253738
4-[6-Isopropyl-2-(trifluoromethyl)pyrimidin-4-YL]-2-(trifluoromethyl)morpholine
CID 56880225
5-{[[6-(cis-3-aminocyclobutyl)-2-(methoxymethyl)-4-pyrimidinyl](methyl)amino]methyl}-N-methyl-2-pyrimidinamine dihydrochloride
CID 91759724
6-(cis-3-aminocyclobutyl)-2-(methoxymethyl)-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 91761352
6-(cis-3-aminocyclobutyl)-N-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 91767768

Frequently Asked Questions

What is the IUPAC name of 4-(6-cyclobutylpyrimidin-4-yl)morpholine?
The IUPAC name of 4-(6-cyclobutylpyrimidin-4-yl)morpholine (CID 119103444) is 4-(6-cyclobutylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(6-cyclobutylpyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(6-cyclobutylpyrimidin-4-yl)morpholine is c1nc(C2CCC2)cc(N2CCOCC2)n1.
What is the InChIKey of 4-(6-cyclobutylpyrimidin-4-yl)morpholine?
The InChIKey is NKLULUSYYZLCHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-2-10(3-1)11-8-12(14-9-13-11)15-4-6-16-7-5-15/h8-10H,1-7H2.
What are the key properties of 4-(6-cyclobutylpyrimidin-4-yl)morpholine?
4-(6-cyclobutylpyrimidin-4-yl)morpholine has a molecular weight of 219.29 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-cyclobutylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 119103444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).