4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine

C12H20N4O — CID 114207025

IUPAC4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine
SMILESCc1nc(C2CN(C(C)C)CCO2)ncc1N
InChIInChI=1S/C12H20N4O/c1-8(2)16-4-5-17-11(7-16)12-14-6-10(13)9(3)15-12/h6,8,11H,4-5,7,13H2,1-3H3
InChIKeyKJBIGLVXUIQLAU-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.15
Rot. Bonds2

About 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine

4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine (PubChem CID 114207025) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine.

Molecular Properties

Compound Name4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine
PubChem CID114207025
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine
SMILESCc1nc(C2CN(C(C)C)CCO2)ncc1N
InChIInChI=1S/C12H20N4O/c1-8(2)16-4-5-17-11(7-16)12-14-6-10(13)9(3)15-12/h6,8,11H,4-5,7,13H2,1-3H3
InChIKeyKJBIGLVXUIQLAU-UHFFFAOYSA-N
XLogP1.15
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine?
The IUPAC name of 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine (CID 114207025) is 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine.
What is the SMILES notation for 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine?
The canonical SMILES for 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine is Cc1nc(C2CN(C(C)C)CCO2)ncc1N.
What is the InChIKey of 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine?
The InChIKey is KJBIGLVXUIQLAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8(2)16-4-5-17-11(7-16)12-14-6-10(13)9(3)15-12/h6,8,11H,4-5,7,13H2,1-3H3.
What are the key properties of 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine?
4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine has a molecular weight of 236.32 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine is sourced from PubChem (CID 114207025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).