N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine

C17H22N4O — CID 112869906

IUPACN-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine
SMILESCCN(c1ccccc1)c1cc(N2CCOCC2)nc(C)n1
InChIInChI=1S/C17H22N4O/c1-3-21(15-7-5-4-6-8-15)17-13-16(18-14(2)19-17)20-9-11-22-12-10-20/h4-8,13H,3,9-12H2,1-2H3
InChIKeyGROPMGSIQJZCKZ-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.78
Rot. Bonds4

About N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine

N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine (PubChem CID 112869906) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine
PubChem CID112869906
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC NameN-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine
SMILESCCN(c1ccccc1)c1cc(N2CCOCC2)nc(C)n1
InChIInChI=1S/C17H22N4O/c1-3-21(15-7-5-4-6-8-15)17-13-16(18-14(2)19-17)20-9-11-22-12-10-20/h4-8,13H,3,9-12H2,1-2H3
InChIKeyGROPMGSIQJZCKZ-UHFFFAOYSA-N
XLogP2.78
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-N-phenylpyrimidin-4-amine
CID 112874796
1-[4-[6-(N-ethylanilino)-2-methylpyrimidin-4-yl]piperazin-1-yl]ethanone
CID 112871236
N-ethyl-N-phenyl-2,6-dipyrrolidin-1-ylpyrimidin-4-amine
CID 173080172
N-ethyl-2-methyl-N-(3-methylphenyl)-6-(4-methylpiperidin-1-yl)pyrimidin-4-amine
CID 112869319
4-N-ethyl-6-methyl-2-N-(2-morpholin-4-ylphenyl)-4-N-phenylpyrimidine-2,4-diamine
CID 112928805
N,N-diethyl-6-morpholin-4-yl-2-phenylpyrimidin-4-amine
CID 112880527
4-[2-methyl-6-(N-methylanilino)pyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112871060
4-[2-methyl-6-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 146074332
4-[6-(azepan-1-yl)-2-methylpyrimidin-4-yl]morpholine
CID 112869889
[6-(N-ethylanilino)-2-methylpyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone
CID 109367085
6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethyl-N-phenylpyrimidin-4-amine
CID 112862686
2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide
CID 109365407

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine?
The IUPAC name of N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine (CID 112869906) is N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine is CCN(c1ccccc1)c1cc(N2CCOCC2)nc(C)n1.
What is the InChIKey of N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine?
The InChIKey is GROPMGSIQJZCKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-3-21(15-7-5-4-6-8-15)17-13-16(18-14(2)19-17)20-9-11-22-12-10-20/h4-8,13H,3,9-12H2,1-2H3.
What are the key properties of N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine?
N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine has a molecular weight of 298.39 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-6-morpholin-4-yl-N-phenylpyrimidin-4-amine is sourced from PubChem (CID 112869906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).