2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol

C9H15N3O2 — CID 80859751

IUPAC2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol
SMILESCCNc1ncc(C)c(OCCO)n1
InChIInChI=1S/C9H15N3O2/c1-3-10-9-11-6-7(2)8(12-9)14-5-4-13/h6,13H,3-5H2,1-2H3,(H,10,11,12)
InChIKeyLZYJHLRENLQWAM-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.59
Rot. Bonds5

About 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol

2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol (PubChem CID 80859751) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol.

Molecular Properties

Compound Name2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol
PubChem CID80859751
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol
SMILESCCNc1ncc(C)c(OCCO)n1
InChIInChI=1S/C9H15N3O2/c1-3-10-9-11-6-7(2)8(12-9)14-5-4-13/h6,13H,3-5H2,1-2H3,(H,10,11,12)
InChIKeyLZYJHLRENLQWAM-UHFFFAOYSA-N
XLogP0.59
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-5-methylpyrimidin-2-amine
CID 113427596
3-[5-bromo-2-(ethylamino)pyrimidin-4-yl]oxypropan-1-ol
CID 80866531
4-butoxy-5-methyl-N-propylpyrimidin-2-amine
CID 80867481
N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
CID 80870503
N-ethyl-5-methyl-4-(oxetan-3-yloxy)pyrimidin-2-amine
CID 102608905
4-[(2-chlorophenyl)methoxy]-N-ethyl-5-methylpyrimidin-2-amine
CID 80859211
4-cycloheptyloxy-N-ethyl-5-methylpyrimidin-2-amine
CID 80871066
N-ethyl-4-(4-iodophenoxy)-5-methylpyrimidin-2-amine
CID 80881024
4-(4-bromophenoxy)-N-ethyl-5-methylpyrimidin-2-amine
CID 80864511
N-ethyl-5-methyl-4-(2,3,5-trimethylphenoxy)pyrimidin-2-amine
CID 80881682
4-[2-(dimethylamino)ethoxy]-5-methyl-N-propylpyrimidin-2-amine
CID 80871082
4-[2-(2-methoxyethoxy)ethoxy]-5-methyl-N-propylpyrimidin-2-amine
CID 104568288

Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol?
The IUPAC name of 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol (CID 80859751) is 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol.
What is the SMILES notation for 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol?
The canonical SMILES for 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol is CCNc1ncc(C)c(OCCO)n1.
What is the InChIKey of 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol?
The InChIKey is LZYJHLRENLQWAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-3-10-9-11-6-7(2)8(12-9)14-5-4-13/h6,13H,3-5H2,1-2H3,(H,10,11,12).
What are the key properties of 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol?
2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol has a molecular weight of 197.24 g/mol, XLogP of 0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylamino)-5-methylpyrimidin-4-yl]oxyethanol is sourced from PubChem (CID 80859751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).