6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine

C14H24N4O2 — CID 102741308

IUPAC6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine
SMILESCCOCc1nc(NC)cc(OCCN(C)C2CC2)n1
InChIInChI=1S/C14H24N4O2/c1-4-19-10-13-16-12(15-2)9-14(17-13)20-8-7-18(3)11-5-6-11/h9,11H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyOHJGCCHCBXGBGX-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.53
Rot. Bonds9

About 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine

6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine (PubChem CID 102741308) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine
PubChem CID102741308
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine
SMILESCCOCc1nc(NC)cc(OCCN(C)C2CC2)n1
InChIInChI=1S/C14H24N4O2/c1-4-19-10-13-16-12(15-2)9-14(17-13)20-8-7-18(3)11-5-6-11/h9,11H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyOHJGCCHCBXGBGX-UHFFFAOYSA-N
XLogP1.53
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine?
The IUPAC name of 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine (CID 102741308) is 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine is CCOCc1nc(NC)cc(OCCN(C)C2CC2)n1.
What is the InChIKey of 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine?
The InChIKey is OHJGCCHCBXGBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-4-19-10-13-16-12(15-2)9-14(17-13)20-8-7-18(3)11-5-6-11/h9,11H,4-8,10H2,1-3H3,(H,15,16,17).
What are the key properties of 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine?
6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine has a molecular weight of 280.37 g/mol, XLogP of 1.53, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[cyclopropyl(methyl)amino]ethoxy]-2-(ethoxymethyl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 102741308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).