N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine

C12H20N4O2 — CID 112638451

IUPACN-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine
SMILESCCCOc1cc(C)nc(NN2CCOCC2)n1
InChIInChI=1S/C12H20N4O2/c1-3-6-18-11-9-10(2)13-12(14-11)15-16-4-7-17-8-5-16/h9H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyXIZFMVZAPWQCCM-UHFFFAOYSA-N
MW252.32 g/mol
LogP1.23
Rot. Bonds5

About N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine

N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine (PubChem CID 112638451) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine.

Molecular Properties

Compound NameN-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine
PubChem CID112638451
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC NameN-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine
SMILESCCCOc1cc(C)nc(NN2CCOCC2)n1
InChIInChI=1S/C12H20N4O2/c1-3-6-18-11-9-10(2)13-12(14-11)15-16-4-7-17-8-5-16/h9H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyXIZFMVZAPWQCCM-UHFFFAOYSA-N
XLogP1.23
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine?
The IUPAC name of N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine (CID 112638451) is N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine.
What is the SMILES notation for N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine?
The canonical SMILES for N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine is CCCOc1cc(C)nc(NN2CCOCC2)n1.
What is the InChIKey of N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine?
The InChIKey is XIZFMVZAPWQCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-6-18-11-9-10(2)13-12(14-11)15-16-4-7-17-8-5-16/h9H,3-8H2,1-2H3,(H,13,14,15).
What are the key properties of N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine?
N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine has a molecular weight of 252.32 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-4-amine is sourced from PubChem (CID 112638451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).