6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine

C14H24N4O — CID 80956097

IUPAC6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(N2CCOCC2)nc(C(C)C)n1
InChIInChI=1S/C14H24N4O/c1-4-5-15-12-10-13(17-14(16-12)11(2)3)18-6-8-19-9-7-18/h10-11H,4-9H2,1-3H3,(H,15,16,17)
InChIKeyBMJLPPAEFZRHOI-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.26
Rot. Bonds5

About 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine

6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine (PubChem CID 80956097) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine
PubChem CID80956097
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(N2CCOCC2)nc(C(C)C)n1
InChIInChI=1S/C14H24N4O/c1-4-5-15-12-10-13(17-14(16-12)11(2)3)18-6-8-19-9-7-18/h10-11H,4-9H2,1-3H3,(H,15,16,17)
InChIKeyBMJLPPAEFZRHOI-UHFFFAOYSA-N
XLogP2.26
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine (CID 80956097) is 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine is CCCNc1cc(N2CCOCC2)nc(C(C)C)n1.
What is the InChIKey of 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine?
The InChIKey is BMJLPPAEFZRHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-5-15-12-10-13(17-14(16-12)11(2)3)18-6-8-19-9-7-18/h10-11H,4-9H2,1-3H3,(H,15,16,17).
What are the key properties of 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine?
6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80956097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).