1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol

C11H18N4O2 — CID 81097827

IUPAC1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol
SMILESCOc1ncnc(N2CCC(C)(O)CC2)c1N
InChIInChI=1S/C11H18N4O2/c1-11(16)3-5-15(6-4-11)9-8(12)10(17-2)14-7-13-9/h7,16H,3-6,12H2,1-2H3
InChIKeyBXKPWRZZNNDUCX-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.42
Rot. Bonds2

About 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol

1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol (PubChem CID 81097827) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol
PubChem CID81097827
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol
SMILESCOc1ncnc(N2CCC(C)(O)CC2)c1N
InChIInChI=1S/C11H18N4O2/c1-11(16)3-5-15(6-4-11)9-8(12)10(17-2)14-7-13-9/h7,16H,3-6,12H2,1-2H3
InChIKeyBXKPWRZZNNDUCX-UHFFFAOYSA-N
XLogP0.42
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(6-amino-5-methylpyrimidin-4-yl)-4-methylpiperidin-4-ol
CID 81108883
4-methoxy-6-(3-methoxypyrrolidin-1-yl)pyrimidin-5-amine
CID 103530461
4-(7,7-dimethyl-1,4-thiazepan-4-yl)-6-ethoxypyrimidin-5-amine
CID 107452824
1-(3-amino-6-methoxy-2-pyridinyl)-4-methylpiperidin-4-ol
CID 115320981
4-(5-amino-6-methoxypyrimidin-4-yl)-1-methyl-1,4-diazepan-2-one
CID 102888328
4-(3-methoxy-3-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
CID 107390598
1-(6-aminoquinazolin-4-yl)-4-methylazepan-4-ol
CID 107403605
4-methoxy-5-methyl-6-pyrrolidin-1-ylpyrimidine
CID 130557587
1-(2-amino-3-methoxyphenyl)-4-methylpiperidin-4-ol
CID 113392759
4-(2-methoxyphenoxy)-6-(4-methylpiperidin-1-yl)pyrimidin-5-amine
CID 19140409
1-(3-methoxy-2-pyridinyl)-4-methylazepan-4-ol
CID 107407374
6-(4,4-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
CID 80823749

Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol?
The IUPAC name of 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol (CID 81097827) is 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol?
The canonical SMILES for 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol is COc1ncnc(N2CCC(C)(O)CC2)c1N.
What is the InChIKey of 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol?
The InChIKey is BXKPWRZZNNDUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-11(16)3-5-15(6-4-11)9-8(12)10(17-2)14-7-13-9/h7,16H,3-6,12H2,1-2H3.
What are the key properties of 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol?
1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol has a molecular weight of 238.29 g/mol, XLogP of 0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-6-methoxypyrimidin-4-yl)-4-methylpiperidin-4-ol is sourced from PubChem (CID 81097827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).