N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine

C14H24N4O — CID 80870503

IUPACN-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
SMILESCCNc1ncc(C)c(OCCC2CCCN2C)n1
InChIInChI=1S/C14H24N4O/c1-4-15-14-16-10-11(2)13(17-14)19-9-7-12-6-5-8-18(12)3/h10,12H,4-9H2,1-3H3,(H,15,16,17)
InChIKeyXSHCHMXYIYCETR-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.08
Rot. Bonds6

About N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine

N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine (PubChem CID 80870503) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
PubChem CID80870503
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
SMILESCCNc1ncc(C)c(OCCC2CCCN2C)n1
InChIInChI=1S/C14H24N4O/c1-4-15-14-16-10-11(2)13(17-14)19-9-7-12-6-5-8-18(12)3/h10,12H,4-9H2,1-3H3,(H,15,16,17)
InChIKeyXSHCHMXYIYCETR-UHFFFAOYSA-N
XLogP2.08
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-5-fluoro-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
CID 80870420
N-ethyl-4-methyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
CID 80871209
N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-5-propylpyrimidin-4-amine
CID 80879280
2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol
CID 80859751
N-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-5-methylpyrimidin-2-amine
CID 113427596
4-cycloheptyloxy-N-ethyl-5-methylpyrimidin-2-amine
CID 80871066
N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridin-2-amine
CID 80870418
N-ethyl-5-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridin-3-amine
CID 113424373
N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
CID 80941958
2-cyclopropyl-N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
CID 80965957
5-bromo-4-(2-cyclopropylethoxy)-N-ethylpyrimidin-2-amine
CID 106207530
N-ethyl-5-methyl-4-(2-methylcyclohexyl)oxypyrimidin-2-amine
CID 80859417

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine?
The IUPAC name of N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine (CID 80870503) is N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine.
What is the SMILES notation for N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine?
The canonical SMILES for N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine is CCNc1ncc(C)c(OCCC2CCCN2C)n1.
What is the InChIKey of N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine?
The InChIKey is XSHCHMXYIYCETR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-15-14-16-10-11(2)13(17-14)19-9-7-12-6-5-8-18(12)3/h10,12H,4-9H2,1-3H3,(H,15,16,17).
What are the key properties of N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine?
N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine has a molecular weight of 264.37 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine is sourced from PubChem (CID 80870503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).