5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine

C13H22N4O — CID 72935483

IUPAC5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine
SMILESCc1cnc(NCC(C)(C)N2CCOCC2)nc1
InChIInChI=1S/C13H22N4O/c1-11-8-14-12(15-9-11)16-10-13(2,3)17-4-6-18-7-5-17/h8-9H,4-7,10H2,1-3H3,(H,14,15,16)
InChIKeyQBPZOZKRYUCFPE-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.31
Rot. Bonds4

About 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine

5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine (PubChem CID 72935483) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine
PubChem CID72935483
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine
SMILESCc1cnc(NCC(C)(C)N2CCOCC2)nc1
InChIInChI=1S/C13H22N4O/c1-11-8-14-12(15-9-11)16-10-13(2,3)17-4-6-18-7-5-17/h8-9H,4-7,10H2,1-3H3,(H,14,15,16)
InChIKeyQBPZOZKRYUCFPE-UHFFFAOYSA-N
XLogP1.31
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 ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine?
The IUPAC name of 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine (CID 72935483) is 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine?
The canonical SMILES for 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine is Cc1cnc(NCC(C)(C)N2CCOCC2)nc1.
What is the InChIKey of 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine?
The InChIKey is QBPZOZKRYUCFPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-11-8-14-12(15-9-11)16-10-13(2,3)17-4-6-18-7-5-17/h8-9H,4-7,10H2,1-3H3,(H,14,15,16).
What are the key properties of 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine?
5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine has a molecular weight of 250.35 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidin-2-amine is sourced from PubChem (CID 72935483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).