4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine

C13H22N4O — CID 19140190

IUPAC4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
SMILESCC(C)Oc1ncnc(N2CCCCC2C)c1N
InChIInChI=1S/C13H22N4O/c1-9(2)18-13-11(14)12(15-8-16-13)17-7-5-4-6-10(17)3/h8-10H,4-7,14H2,1-3H3
InChIKeyBUWGXZZYLYFDEG-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.22
Rot. Bonds3

About 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine

4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine (PubChem CID 19140190) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine.

Molecular Properties

Compound Name4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
PubChem CID19140190
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
SMILESCC(C)Oc1ncnc(N2CCCCC2C)c1N
InChIInChI=1S/C13H22N4O/c1-9(2)18-13-11(14)12(15-8-16-13)17-7-5-4-6-10(17)3/h8-10H,4-7,14H2,1-3H3
InChIKeyBUWGXZZYLYFDEG-UHFFFAOYSA-N
XLogP2.22
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 ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine?
The IUPAC name of 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine (CID 19140190) is 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine.
What is the SMILES notation for 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine?
The canonical SMILES for 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine is CC(C)Oc1ncnc(N2CCCCC2C)c1N.
What is the InChIKey of 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine?
The InChIKey is BUWGXZZYLYFDEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-9(2)18-13-11(14)12(15-8-16-13)17-7-5-4-6-10(17)3/h8-10H,4-7,14H2,1-3H3.
What are the key properties of 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine?
4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine has a molecular weight of 250.35 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine is sourced from PubChem (CID 19140190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).