2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine

C13H22N4O — CID 80767316

IUPAC2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C)nc(N2CCOCC2)c1C
InChIInChI=1S/C13H22N4O/c1-4-5-14-12-10(2)13(16-11(3)15-12)17-6-8-18-9-7-17/h4-9H2,1-3H3,(H,14,15,16)
InChIKeyLBHYEZNDQVXNDU-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.75
Rot. Bonds4

About 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine

2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine (PubChem CID 80767316) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine
PubChem CID80767316
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C)nc(N2CCOCC2)c1C
InChIInChI=1S/C13H22N4O/c1-4-5-14-12-10(2)13(16-11(3)15-12)17-6-8-18-9-7-17/h4-9H2,1-3H3,(H,14,15,16)
InChIKeyLBHYEZNDQVXNDU-UHFFFAOYSA-N
XLogP1.75
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,3-dimethylpyrrolidin-1-yl)-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 80854736
1-[2,5-dimethyl-6-(propylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol
CID 106674594
6-(4-ethylazepan-1-yl)-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 80823095
1-[2,5-dimethyl-6-(propylamino)pyrimidin-4-yl]piperidin-3-ol
CID 80779109
6-N-ethyl-2,5-dimethyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 80778253
2,5-dimethyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80836387
N-ethyl-5-methyl-6-(1,4-oxazepan-4-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80984409
1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]piperidin-4-ol
CID 80764591
5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80986419
2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80986418
6-(3,5-dimethylpyrazol-1-yl)-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 80852866
1-[4-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]piperazin-1-yl]ethanone
CID 80766566

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine?
The IUPAC name of 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine (CID 80767316) is 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine is CCCNc1nc(C)nc(N2CCOCC2)c1C.
What is the InChIKey of 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine?
The InChIKey is LBHYEZNDQVXNDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-5-14-12-10(2)13(16-11(3)15-12)17-6-8-18-9-7-17/h4-9H2,1-3H3,(H,14,15,16).
What are the key properties of 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine?
2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80767316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).