5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine

C16H28N4O — CID 80986419

IUPAC5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C(C)C)nc(N2CCOCC2C)c1C
InChIInChI=1S/C16H28N4O/c1-6-7-17-15-13(5)16(19-14(18-15)11(2)3)20-8-9-21-10-12(20)4/h11-12H,6-10H2,1-5H3,(H,17,18,19)
InChIKeyUQMUCBNQKQVRML-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.96
Rot. Bonds5

About 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine

5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine (PubChem CID 80986419) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
PubChem CID80986419
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C(C)C)nc(N2CCOCC2C)c1C
InChIInChI=1S/C16H28N4O/c1-6-7-17-15-13(5)16(19-14(18-15)11(2)3)20-8-9-21-10-12(20)4/h11-12H,6-10H2,1-5H3,(H,17,18,19)
InChIKeyUQMUCBNQKQVRML-UHFFFAOYSA-N
XLogP2.96
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80986418
6-(2,5-dimethylmorpholin-4-yl)-N-ethyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80986421
N-ethyl-5-methyl-6-(3-methylmorpholin-4-yl)-2-propylpyrimidin-4-amine
CID 80993713
N-ethyl-5-methyl-6-(1,4-oxazepan-4-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80984409
[4-[2,5-dimethyl-6-(propylamino)pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol
CID 81216976
6-(2,5-dimethylmorpholin-4-yl)-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 80993238
2-tert-butyl-N,5-dimethyl-6-(3-methylmorpholin-4-yl)pyrimidin-4-amine
CID 80993569
2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine
CID 80767316
2,5-dimethyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80836387
5-bromo-4-(3-methylmorpholin-4-yl)-N-propylpyrimidin-2-amine
CID 80780829
N-ethyl-5-methyl-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80981685
4-N-butyl-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80980995

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
The IUPAC name of 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine (CID 80986419) is 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
The canonical SMILES for 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine is CCCNc1nc(C(C)C)nc(N2CCOCC2C)c1C.
What is the InChIKey of 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
The InChIKey is UQMUCBNQKQVRML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-6-7-17-15-13(5)16(19-14(18-15)11(2)3)20-8-9-21-10-12(20)4/h11-12H,6-10H2,1-5H3,(H,17,18,19).
What are the key properties of 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine has a molecular weight of 292.43 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80986419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).