1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine

C14H24N4O — CID 106321805

IUPAC1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
SMILESCCOc1cc(N2CCC(C)(CNC)C2)nc(C)n1
InChIInChI=1S/C14H24N4O/c1-5-19-13-8-12(16-11(2)17-13)18-7-6-14(3,10-18)9-15-4/h8,15H,5-7,9-10H2,1-4H3
InChIKeyFLEXWYKEVRCZRW-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.62
Rot. Bonds5

About 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine

1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine (PubChem CID 106321805) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
PubChem CID106321805
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
SMILESCCOc1cc(N2CCC(C)(CNC)C2)nc(C)n1
InChIInChI=1S/C14H24N4O/c1-5-19-13-8-12(16-11(2)17-13)18-7-6-14(3,10-18)9-15-4/h8,15H,5-7,9-10H2,1-4H3
InChIKeyFLEXWYKEVRCZRW-UHFFFAOYSA-N
XLogP1.62
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(6-methoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321931
[1-(6-ethoxy-2-methylpyrimidin-4-yl)-4-methylpiperidin-4-yl]methanamine
CID 107160328
1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpiperidine-3-carboxylic acid
CID 66333107
6-ethoxy-2-methyl-N-[(1-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 66327746
1-[1-(5-methoxy-2-pyridinyl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321981
1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-4-amine
CID 66332707
N-methyl-1-[3-methyl-1-(4-propoxypyrimidin-2-yl)pyrrolidin-3-yl]methanamine
CID 106321862
2-[4-(6-ethoxy-2-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
CID 66333920
N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine
CID 106321908
N-[[4-(6-ethoxy-2-methylpyrimidin-4-yl)-2-methylmorpholin-2-yl]methyl]-5,5-dimethylhexanamide
CID 138049196
1-[1-(3-bromo-5-chloro-2-pyridinyl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321819
4-[3-(bromomethyl)pyrrolidin-1-yl]-6-ethoxy-2-methylpyrimidine
CID 80679971

Frequently Asked Questions

What is the IUPAC name of 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine (CID 106321805) is 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine is CCOc1cc(N2CCC(C)(CNC)C2)nc(C)n1.
What is the InChIKey of 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine?
The InChIKey is FLEXWYKEVRCZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-19-13-8-12(16-11(2)17-13)18-7-6-14(3,10-18)9-15-4/h8,15H,5-7,9-10H2,1-4H3.
What are the key properties of 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine?
1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine has a molecular weight of 264.37 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(6-ethoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 106321805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).