N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine

C13H22N4O — CID 80873426

IUPACN-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine
SMILESCCNc1cc(OC2CCN(C)CC2)nc(C)n1
InChIInChI=1S/C13H22N4O/c1-4-14-12-9-13(16-10(2)15-12)18-11-5-7-17(3)8-6-11/h9,11H,4-8H2,1-3H3,(H,14,15,16)
InChIKeyNOGDGXDHPBFPEE-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.69
Rot. Bonds4

About N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine

N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine (PubChem CID 80873426) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine
PubChem CID80873426
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine
SMILESCCNc1cc(OC2CCN(C)CC2)nc(C)n1
InChIInChI=1S/C13H22N4O/c1-4-14-12-9-13(16-10(2)15-12)18-11-5-7-17(3)8-6-11/h9,11H,4-8H2,1-3H3,(H,14,15,16)
InChIKeyNOGDGXDHPBFPEE-UHFFFAOYSA-N
XLogP1.69
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-methyl-6-(oxan-4-yloxy)pyrimidin-4-amine
CID 80873271
6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine
CID 80873247
2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine
CID 80872793
2-ethyl-N-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine
CID 80942580
6-cyclobutyloxy-N-ethyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774446
6-cyclohexyloxy-2-cyclopropyl-N-ethylpyrimidin-4-amine
CID 80965359
6-cycloheptyloxy-4-N-ethylpyrimidine-2,4-diamine
CID 80870965
N-ethyl-6-(4-methoxypiperidin-1-yl)-2-methylpyrimidin-4-amine
CID 80783406
N-ethyl-2-methyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80870434
N,2-diethyl-6-(oxan-4-yloxy)pyrimidin-4-amine
CID 80942154
6-cyclohexyloxy-N-ethyl-2-methylsulfanylpyrimidin-4-amine
CID 80858375
6-N,2-diethyl-4-N-[(1-methylpiperidin-4-yl)methyl]pyrimidine-4,6-diamine
CID 80935176

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine?
The IUPAC name of N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine (CID 80873426) is N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine is CCNc1cc(OC2CCN(C)CC2)nc(C)n1.
What is the InChIKey of N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine?
The InChIKey is NOGDGXDHPBFPEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-14-12-9-13(16-10(2)15-12)18-11-5-7-17(3)8-6-11/h9,11H,4-8H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine?
N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine is sourced from PubChem (CID 80873426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).