2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine

C15H26N4O — CID 83185230

IUPAC2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine
SMILESCc1nc(N2CCOC(C)C2)ncc1CNCC(C)C
InChIInChI=1S/C15H26N4O/c1-11(2)7-16-8-14-9-17-15(18-13(14)4)19-5-6-20-12(3)10-19/h9,11-12,16H,5-8,10H2,1-4H3
InChIKeyMGJXYFGBRCOHPS-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.76
Rot. Bonds5

About 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine

2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine (PubChem CID 83185230) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine
PubChem CID83185230
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine
SMILESCc1nc(N2CCOC(C)C2)ncc1CNCC(C)C
InChIInChI=1S/C15H26N4O/c1-11(2)7-16-8-14-9-17-15(18-13(14)4)19-5-6-20-12(3)10-19/h9,11-12,16H,5-8,10H2,1-4H3
InChIKeyMGJXYFGBRCOHPS-UHFFFAOYSA-N
XLogP1.76
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine (CID 83185230) is 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine is Cc1nc(N2CCOC(C)C2)ncc1CNCC(C)C.
What is the InChIKey of 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine?
The InChIKey is MGJXYFGBRCOHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)7-16-8-14-9-17-15(18-13(14)4)19-5-6-20-12(3)10-19/h9,11-12,16H,5-8,10H2,1-4H3.
What are the key properties of 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine?
2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine has a molecular weight of 278.40 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-methyl-2-(2-methylmorpholin-4-yl)pyrimidin-5-yl]methyl]propan-1-amine is sourced from PubChem (CID 83185230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).