4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine

C9H15N3O3 — CID 104568278

IUPAC4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine
SMILESCOCCOCCOc1ccnc(N)n1
InChIInChI=1S/C9H15N3O3/c1-13-4-5-14-6-7-15-8-2-3-11-9(10)12-8/h2-3H,4-7H2,1H3,(H2,10,11,12)
InChIKeySNCFDFQWMIADBS-UHFFFAOYSA-N
MW213.24 g/mol
LogP0.10
Rot. Bonds7

About 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine

4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine (PubChem CID 104568278) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine
PubChem CID104568278
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC Name4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine
SMILESCOCCOCCOc1ccnc(N)n1
InChIInChI=1S/C9H15N3O3/c1-13-4-5-14-6-7-15-8-2-3-11-9(10)12-8/h2-3H,4-7H2,1H3,(H2,10,11,12)
InChIKeySNCFDFQWMIADBS-UHFFFAOYSA-N
XLogP0.10
TPSA79.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-(2-butoxyethoxy)pyrimidin-2-amine
CID 80861687
2-chloro-4-[2-(2-methoxyethoxy)ethoxy]pyrimidine
CID 104561376
[4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-yl]hydrazine
CID 104568494
4-propoxypyrimidin-2-amine
CID 79002172
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridin-4-amine
CID 104559850
4-[2-(2-methoxyethoxy)ethoxy]-N-methylpyrimidin-2-amine
CID 104568221
6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpyridin-3-amine
CID 104559873
4-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethoxy]pyrimidin-2-amine
CID 10640381
2-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridin-3-amine
CID 104559880
2-[2-(2-methoxyethoxy)ethoxy]pyrimidin-4-amine
CID 116798022
2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine
CID 104561399
4-(2-methoxyethoxy)pyrimidine-2-carboxylic acid
CID 124926290

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine?
The IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine (CID 104568278) is 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine.
What is the SMILES notation for 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine?
The canonical SMILES for 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine is COCCOCCOc1ccnc(N)n1.
What is the InChIKey of 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine?
The InChIKey is SNCFDFQWMIADBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c1-13-4-5-14-6-7-15-8-2-3-11-9(10)12-8/h2-3H,4-7H2,1H3,(H2,10,11,12).
What are the key properties of 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine?
4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine has a molecular weight of 213.24 g/mol, XLogP of 0.10, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine is sourced from PubChem (CID 104568278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).