4-(2-cyclopropylethoxy)pyrimidin-5-amine

C9H13N3O — CID 106199537

IUPAC4-(2-cyclopropylethoxy)pyrimidin-5-amine
SMILESNc1cncnc1OCCC1CC1
InChIInChI=1S/C9H13N3O/c10-8-5-11-6-12-9(8)13-4-3-7-1-2-7/h5-7H,1-4,10H2
InChIKeyZBYQZHGLPMYNHW-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.24
Rot. Bonds4

About 4-(2-cyclopropylethoxy)pyrimidin-5-amine

4-(2-cyclopropylethoxy)pyrimidin-5-amine (PubChem CID 106199537) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 4-(2-cyclopropylethoxy)pyrimidin-5-amine.

Molecular Properties

Compound Name4-(2-cyclopropylethoxy)pyrimidin-5-amine
PubChem CID106199537
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name4-(2-cyclopropylethoxy)pyrimidin-5-amine
SMILESNc1cncnc1OCCC1CC1
InChIInChI=1S/C9H13N3O/c10-8-5-11-6-12-9(8)13-4-3-7-1-2-7/h5-7H,1-4,10H2
InChIKeyZBYQZHGLPMYNHW-UHFFFAOYSA-N
XLogP1.24
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(cyclopropylmethoxy)pyrimidin-5-amine
CID 79918233
2-(2-cyclopropylethoxy)-5-methylpyridin-3-amine
CID 106199639
2-(2-cyclopropylethoxy)pyridin-3-amine
CID 106199565
4-hexoxypyrimidin-5-amine
CID 79916301
6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine
CID 106207430
4-[3-(dimethylamino)propoxy]pyrimidin-5-amine
CID 79919093
4-(2-cyclopropylethoxy)-6-propan-2-yloxypyrimidin-5-amine
CID 106199609
5-chloro-4-(2-cyclopropylethoxy)pyrimidin-2-amine
CID 106207418
4-[2-(dimethylamino)-2-methylpropoxy]pyrimidin-5-amine
CID 79918434
5-iodo-4-(2-pyrrolidin-3-ylethoxy)pyrimidine
CID 114796262
[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine
CID 106207875
6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine
CID 106207794

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropylethoxy)pyrimidin-5-amine?
The IUPAC name of 4-(2-cyclopropylethoxy)pyrimidin-5-amine (CID 106199537) is 4-(2-cyclopropylethoxy)pyrimidin-5-amine.
What is the SMILES notation for 4-(2-cyclopropylethoxy)pyrimidin-5-amine?
The canonical SMILES for 4-(2-cyclopropylethoxy)pyrimidin-5-amine is Nc1cncnc1OCCC1CC1.
What is the InChIKey of 4-(2-cyclopropylethoxy)pyrimidin-5-amine?
The InChIKey is ZBYQZHGLPMYNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c10-8-5-11-6-12-9(8)13-4-3-7-1-2-7/h5-7H,1-4,10H2.
What are the key properties of 4-(2-cyclopropylethoxy)pyrimidin-5-amine?
4-(2-cyclopropylethoxy)pyrimidin-5-amine has a molecular weight of 179.22 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropylethoxy)pyrimidin-5-amine is sourced from PubChem (CID 106199537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).