6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine

C13H22N4O2 — CID 50953027

IUPAC6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
SMILESCOc1cc(NC(C)(C)CN2CCOCC2)ncn1
InChIInChI=1S/C13H22N4O2/c1-13(2,9-17-4-6-19-7-5-17)16-11-8-12(18-3)15-10-14-11/h8,10H,4-7,9H2,1-3H3,(H,14,15,16)
InChIKeyPLFVGMCMRPVHBK-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.01
Rot. Bonds5

About 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine

6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine (PubChem CID 50953027) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
PubChem CID50953027
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
SMILESCOc1cc(NC(C)(C)CN2CCOCC2)ncn1
InChIInChI=1S/C13H22N4O2/c1-13(2,9-17-4-6-19-7-5-17)16-11-8-12(18-3)15-10-14-11/h8,10H,4-7,9H2,1-3H3,(H,14,15,16)
InChIKeyPLFVGMCMRPVHBK-UHFFFAOYSA-N
XLogP1.01
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(6-Methoxypyrimidin-4-yl)morpholine
CID 3242788
Pyrimidine, 2,4-diamino-6-(2-(diethylamino)ethoxy)-
CID 202117
4-Methoxy-2-(piperazin-1-yl)pyrimidine
CID 11480987
4,6-Dimethoxy-2-(piperazin-1-ylmethyl)pyrimidine
CID 2736218
4-Methoxy-6-(piperazin-1-yl)pyrimidine
CID 45789017
(4aS,9aS)-7-(6-methoxypyrimidin-4-yl)-4-methyl-2,3,4a,5,6,8,9,9a-octahydro-[1,4]oxazino[2,3-d]azepine
CID 97511034
4-Methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25129178
4-Ethoxy-2-(piperazin-1-yl)pyrimidine
CID 17855548
2-[2-[4-[2-(Dimethylamino)ethoxy]-6-(2-methoxyethylamino)pyrimidin-2-yl]oxyethyl]guanidine;hydrochloride
CID 44577031
2-[3-[4-[2-(Dimethylamino)ethoxy]-6-(2-methoxyethylamino)pyrimidin-2-yl]oxypropyl]guanidine;hydrochloride
CID 44577033
2-(2-aminoethoxy)-6-[2-(dimethylamino)ethoxy]-N-(2-methoxyethyl)pyrimidin-4-amine
CID 44577491
2-(3-aminopropoxy)-6-[2-(dimethylamino)ethoxy]-N-(2-methoxyethyl)pyrimidin-4-amine
CID 44577492

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine (CID 50953027) is 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine is COc1cc(NC(C)(C)CN2CCOCC2)ncn1.
What is the InChIKey of 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
The InChIKey is PLFVGMCMRPVHBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-13(2,9-17-4-6-19-7-5-17)16-11-8-12(18-3)15-10-14-11/h8,10H,4-7,9H2,1-3H3,(H,14,15,16).
What are the key properties of 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine has a molecular weight of 266.34 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(2-methyl-1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 50953027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).