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

C15H26N4O — CID 107160311

IUPAC[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine
SMILESCc1cc(OC(C)C)nc(N2CCC(C)(CN)CC2)n1
InChIInChI=1S/C15H26N4O/c1-11(2)20-13-9-12(3)17-14(18-13)19-7-5-15(4,10-16)6-8-19/h9,11H,5-8,10,16H2,1-4H3
InChIKeyFFTAPHCTZJUPSJ-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.14
Rot. Bonds4

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

[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine (PubChem CID 107160311) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine
PubChem CID107160311
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine
SMILESCc1cc(OC(C)C)nc(N2CCC(C)(CN)CC2)n1
InChIInChI=1S/C15H26N4O/c1-11(2)20-13-9-12(3)17-14(18-13)19-7-5-15(4,10-16)6-8-19/h9,11H,5-8,10,16H2,1-4H3
InChIKeyFFTAPHCTZJUPSJ-UHFFFAOYSA-N
XLogP2.14
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine?
The IUPAC name of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine (CID 107160311) is [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine.
What is the SMILES notation for [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine?
The canonical SMILES for [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine is Cc1cc(OC(C)C)nc(N2CCC(C)(CN)CC2)n1.
What is the InChIKey of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine?
The InChIKey is FFTAPHCTZJUPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)20-13-9-12(3)17-14(18-13)19-7-5-15(4,10-16)6-8-19/h9,11H,5-8,10,16H2,1-4H3.
What are the key properties of [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine?
[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine has a molecular weight of 278.40 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine is sourced from PubChem (CID 107160311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).