1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine

C19H26N4O — CID 133460647

IUPAC1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine
SMILESCCc1cc(N2CCC(Nc3cccc(OC)c3)CC2)nc(C)n1
InChIInChI=1S/C19H26N4O/c1-4-15-13-19(21-14(2)20-15)23-10-8-16(9-11-23)22-17-6-5-7-18(12-17)24-3/h5-7,12-13,16,22H,4,8-11H2,1-3H3
InChIKeyCETHBJVKYBQETB-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.44
Rot. Bonds5

About 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine

1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine (PubChem CID 133460647) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine
PubChem CID133460647
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine
SMILESCCc1cc(N2CCC(Nc3cccc(OC)c3)CC2)nc(C)n1
InChIInChI=1S/C19H26N4O/c1-4-15-13-19(21-14(2)20-15)23-10-8-16(9-11-23)22-17-6-5-7-18(12-17)24-3/h5-7,12-13,16,22H,4,8-11H2,1-3H3
InChIKeyCETHBJVKYBQETB-UHFFFAOYSA-N
XLogP3.44
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methoxyphenyl)-1-(2,3,5,6-tetrafluoro-4-pyridinyl)piperidin-4-amine
CID 133372597
4-[3-(3-chlorophenoxy)pyrrolidin-1-yl]-6-ethyl-2-methylpyrimidine
CID 133462129
N-(3-methoxyphenyl)-2-methyl-6-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109364198
1-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-N-(3-methoxyphenyl)piperidin-4-amine
CID 75439321
4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine
CID 133460751
N-(3-methoxyphenyl)-2-methyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 112874751
4-[3-(2-chlorophenoxy)pyrrolidin-1-yl]-6-ethyl-2-methylpyrimidine
CID 133461969
N-(3-methoxyphenyl)-1-(1,3,4-thiadiazol-2-ylmethyl)piperidin-4-amine
CID 138027618
N-[1-[(3,5-dimethoxyphenyl)methyl]pyrrolidin-3-yl]-6-ethyl-2-methylpyrimidin-4-amine
CID 133472325
(3R,5R)-1-(6-ethyl-2-methylpyrimidin-4-yl)-5-(3-methoxyphenyl)pyrrolidin-3-ol
CID 129481983
1-(6-ethyl-2-methylpyrimidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]piperidin-4-amine
CID 72916795
N-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]-6-methoxyquinolin-2-amine
CID 167824861

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine?
The IUPAC name of 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine (CID 133460647) is 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine.
What is the SMILES notation for 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine?
The canonical SMILES for 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine is CCc1cc(N2CCC(Nc3cccc(OC)c3)CC2)nc(C)n1.
What is the InChIKey of 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine?
The InChIKey is CETHBJVKYBQETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-4-15-13-19(21-14(2)20-15)23-10-8-16(9-11-23)22-17-6-5-7-18(12-17)24-3/h5-7,12-13,16,22H,4,8-11H2,1-3H3.
What are the key properties of 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine?
1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine has a molecular weight of 326.44 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine is sourced from PubChem (CID 133460647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).