[6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine

C13H22N4O — CID 79663846

IUPAC[6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine
SMILESCc1cc(CN)nc(C2CN(C(C)C)CCO2)n1
InChIInChI=1S/C13H22N4O/c1-9(2)17-4-5-18-12(8-17)13-15-10(3)6-11(7-14)16-13/h6,9,12H,4-5,7-8,14H2,1-3H3
InChIKeyDDGDONSFRUKPIM-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.03
Rot. Bonds3

About [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine

[6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine (PubChem CID 79663846) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine.

Molecular Properties

Compound Name[6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine
PubChem CID79663846
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name[6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine
SMILESCc1cc(CN)nc(C2CN(C(C)C)CCO2)n1
InChIInChI=1S/C13H22N4O/c1-9(2)17-4-5-18-12(8-17)13-15-10(3)6-11(7-14)16-13/h6,9,12H,4-5,7-8,14H2,1-3H3
InChIKeyDDGDONSFRUKPIM-UHFFFAOYSA-N
XLogP1.03
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine 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 [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine?
The IUPAC name of [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine (CID 79663846) is [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine.
What is the SMILES notation for [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine?
The canonical SMILES for [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine is Cc1cc(CN)nc(C2CN(C(C)C)CCO2)n1.
What is the InChIKey of [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine?
The InChIKey is DDGDONSFRUKPIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-9(2)17-4-5-18-12(8-17)13-15-10(3)6-11(7-14)16-13/h6,9,12H,4-5,7-8,14H2,1-3H3.
What are the key properties of [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine?
[6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine has a molecular weight of 250.35 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methanamine is sourced from PubChem (CID 79663846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).