[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine

C14H25N5O — CID 115973553

IUPAC[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine
SMILESCc1cc(OC(C)C)nc(N2CCN(C)CC2CN)n1
InChIInChI=1S/C14H25N5O/c1-10(2)20-13-7-11(3)16-14(17-13)19-6-5-18(4)9-12(19)8-15/h7,10,12H,5-6,8-9,15H2,1-4H3
InChIKeyDYLRDXQNHDJKLI-UHFFFAOYSA-N
MW279.39 g/mol
LogP0.65
Rot. Bonds4

About [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine

[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine (PubChem CID 115973553) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine
PubChem CID115973553
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine
SMILESCc1cc(OC(C)C)nc(N2CCN(C)CC2CN)n1
InChIInChI=1S/C14H25N5O/c1-10(2)20-13-7-11(3)16-14(17-13)19-6-5-18(4)9-12(19)8-15/h7,10,12H,5-6,8-9,15H2,1-4H3
InChIKeyDYLRDXQNHDJKLI-UHFFFAOYSA-N
XLogP0.65
TPSA67.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-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 [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine?
The IUPAC name of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine (CID 115973553) is [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine.
What is the SMILES notation for [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine?
The canonical SMILES for [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine is Cc1cc(OC(C)C)nc(N2CCN(C)CC2CN)n1.
What is the InChIKey of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine?
The InChIKey is DYLRDXQNHDJKLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-10(2)20-13-7-11(3)16-14(17-13)19-6-5-18(4)9-12(19)8-15/h7,10,12H,5-6,8-9,15H2,1-4H3.
What are the key properties of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine?
[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine has a molecular weight of 279.39 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperazin-2-yl]methanamine is sourced from PubChem (CID 115973553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).