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

C7H11N3O2 — CID 79918226

IUPAC4-(2-methoxyethoxy)pyrimidin-5-amine
SMILESCOCCOc1ncncc1N
InChIInChI=1S/C7H11N3O2/c1-11-2-3-12-7-6(8)4-9-5-10-7/h4-5H,2-3,8H2,1H3
InChIKeyVYGJVMUJXCGRLB-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.08
Rot. Bonds4

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

4-(2-methoxyethoxy)pyrimidin-5-amine (PubChem CID 79918226) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)pyrimidin-5-amine.

Molecular Properties

Compound Name4-(2-methoxyethoxy)pyrimidin-5-amine
PubChem CID79918226
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name4-(2-methoxyethoxy)pyrimidin-5-amine
SMILESCOCCOc1ncncc1N
InChIInChI=1S/C7H11N3O2/c1-11-2-3-12-7-6(8)4-9-5-10-7/h4-5H,2-3,8H2,1H3
InChIKeyVYGJVMUJXCGRLB-UHFFFAOYSA-N
XLogP0.08
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-Methoxypyrimidin-5-amine
CID 13277465
2-Chloro-4-methoxypyrimidin-5-amine
CID 21186356
N-(2,4-dimethoxypyrimidin-5-yl)propionamide
CID 71807563
Pyrimidine, 2-dimethylamino-4-ethoxy-5-nitro-
CID 171384693
7H-Pyrimido[4,5-b][1,4]oxazine
CID 45080409
4-Methoxy-5-acetamidopyrimidine
CID 126971276
5-Azido-2,4-dimethoxypyrimidine
CID 132991782
N-(2,4-dimethoxypyrimidin-5-yl)isobutyramide
CID 71807565
N-(2,4-Diethoxypyrimidin-5-YL)propanamide
CID 71807604
4-(2,2,2-Trifluoroethoxy)pyrimidin-5-amine
CID 79917223
2-Fluoro-4-(propan-2-yloxy)pyrimidin-5-amine
CID 140515494
5-(4,5-Dihydroimidazol-1-yl)-4-ethoxy-2-(trifluoromethyl)pyrimidine
CID 154402255

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethoxy)pyrimidin-5-amine?
The IUPAC name of 4-(2-methoxyethoxy)pyrimidin-5-amine (CID 79918226) is 4-(2-methoxyethoxy)pyrimidin-5-amine.
What is the SMILES notation for 4-(2-methoxyethoxy)pyrimidin-5-amine?
The canonical SMILES for 4-(2-methoxyethoxy)pyrimidin-5-amine is COCCOc1ncncc1N.
What is the InChIKey of 4-(2-methoxyethoxy)pyrimidin-5-amine?
The InChIKey is VYGJVMUJXCGRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-11-2-3-12-7-6(8)4-9-5-10-7/h4-5H,2-3,8H2,1H3.
What are the key properties of 4-(2-methoxyethoxy)pyrimidin-5-amine?
4-(2-methoxyethoxy)pyrimidin-5-amine has a molecular weight of 169.18 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)pyrimidin-5-amine is sourced from PubChem (CID 79918226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).