N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine

C15H26N4O — CID 80870502

IUPACN-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine
SMILESCCCc1c(NC)ncnc1OCCN1CCCCC1
InChIInChI=1S/C15H26N4O/c1-3-7-13-14(16-2)17-12-18-15(13)20-11-10-19-8-5-4-6-9-19/h12H,3-11H2,1-2H3,(H,16,17,18)
InChIKeyNDRFGXQYLHQPPD-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.34
Rot. Bonds7

About N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine

N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine (PubChem CID 80870502) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine
PubChem CID80870502
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine
SMILESCCCc1c(NC)ncnc1OCCN1CCCCC1
InChIInChI=1S/C15H26N4O/c1-3-7-13-14(16-2)17-12-18-15(13)20-11-10-19-8-5-4-6-9-19/h12H,3-11H2,1-2H3,(H,16,17,18)
InChIKeyNDRFGXQYLHQPPD-UHFFFAOYSA-N
XLogP2.34
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine?
The IUPAC name of N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine (CID 80870502) is N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine?
The canonical SMILES for N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine is CCCc1c(NC)ncnc1OCCN1CCCCC1.
What is the InChIKey of N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine?
The InChIKey is NDRFGXQYLHQPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-3-7-13-14(16-2)17-12-18-15(13)20-11-10-19-8-5-4-6-9-19/h12H,3-11H2,1-2H3,(H,16,17,18).
What are the key properties of N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine?
N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine is sourced from PubChem (CID 80870502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).