6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine

C15H26N4O — CID 80959307

IUPAC6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(N2CCC(COC)CC2)nc(C(C)C)n1
InChIInChI=1S/C15H26N4O/c1-11(2)15-17-13(16-3)9-14(18-15)19-7-5-12(6-8-19)10-20-4/h9,11-12H,5-8,10H2,1-4H3,(H,16,17,18)
InChIKeyWALHMLFAFRHQEF-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.50
Rot. Bonds5

About 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine

6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80959307) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID80959307
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(N2CCC(COC)CC2)nc(C(C)C)n1
InChIInChI=1S/C15H26N4O/c1-11(2)15-17-13(16-3)9-14(18-15)19-7-5-12(6-8-19)10-20-4/h9,11-12H,5-8,10H2,1-4H3,(H,16,17,18)
InChIKeyWALHMLFAFRHQEF-UHFFFAOYSA-N
XLogP2.50
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80956947
6-(4-cyclopropylpiperazin-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80962074
N-ethyl-6-(4-ethylpiperidin-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80960827
4-[4-(methoxymethyl)piperidin-1-yl]-N,6-dimethylpyrimidin-2-amine
CID 80838759
[6-[4-(methoxymethyl)piperidin-1-yl]-2-methylpyrimidin-4-yl]hydrazine
CID 80911487
6-(4,4-dimethylazepan-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80960267
4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol
CID 81107552
6-(3,5-dimethylpiperidin-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80956223
6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine
CID 106590173
4-[4-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyrimidine
CID 66801525
N-ethyl-6-(3-methoxypyrrolidin-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 103541756
6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81469827

Frequently Asked Questions

What is the IUPAC name of 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine (CID 80959307) is 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine is CNc1cc(N2CCC(COC)CC2)nc(C(C)C)n1.
What is the InChIKey of 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is WALHMLFAFRHQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)15-17-13(16-3)9-14(18-15)19-7-5-12(6-8-19)10-20-4/h9,11-12H,5-8,10H2,1-4H3,(H,16,17,18).
What are the key properties of 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine?
6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(methoxymethyl)piperidin-1-yl]-N-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80959307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).