6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine

C13H23N3O2 — CID 102928875

IUPAC6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(CCOCCOC)nc(NC)c1C
InChIInChI=1S/C13H23N3O2/c1-5-11-10(2)13(14-3)16-12(15-11)6-7-18-9-8-17-4/h5-9H2,1-4H3,(H,14,15,16)
InChIKeyZGYBSXGCQQWJIG-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.59
Rot. Bonds8

About 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine

6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine (PubChem CID 102928875) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine
PubChem CID102928875
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(CCOCCOC)nc(NC)c1C
InChIInChI=1S/C13H23N3O2/c1-5-11-10(2)13(14-3)16-12(15-11)6-7-18-9-8-17-4/h5-9H2,1-4H3,(H,14,15,16)
InChIKeyZGYBSXGCQQWJIG-UHFFFAOYSA-N
XLogP1.59
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.59
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

[6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-5-methylpyrimidin-4-yl]hydrazine
CID 102928978
[6-ethyl-2-(2-methoxyethyl)-5-methylpyrimidin-4-yl]hydrazine
CID 63560256
6-ethyl-5-iodo-2-(2-methoxyethyl)-N-methylpyrimidin-4-amine
CID 66300059
2-[2-(dimethylamino)ethyl]-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 115347025
2-ethyl-6-(2-methoxyethoxy)-N,5-dimethylpyrimidin-4-amine
CID 80988826
2-[2-(2-methoxyethoxy)ethyl]-N-methyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 102928850
5-bromo-6-cyclopentyl-2-[2-(2-methoxyethoxy)ethyl]-N-methylpyrimidin-4-amine
CID 102928957
N-ethyl-5-iodo-2-[2-(2-methoxyethoxy)ethyl]-6-(2-methylpropyl)pyrimidin-4-amine
CID 102928949
N-ethyl-3-[2-[2-(2-methoxyethoxy)ethyl]-4,6-dimethylpyrimidin-5-yl]propan-1-amine
CID 102929114
N,6-diethyl-2-(methoxymethyl)-5-methylpyrimidin-4-amine
CID 63559829
4-chloro-2-[2-(2-methoxyethoxy)ethyl]-5,6-dimethylpyrimidine
CID 102927201
N,6-diethyl-5-iodo-2-(2-methoxyethyl)pyrimidin-4-amine
CID 66298694

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine (CID 102928875) is 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine is CCc1nc(CCOCCOC)nc(NC)c1C.
What is the InChIKey of 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine?
The InChIKey is ZGYBSXGCQQWJIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-5-11-10(2)13(14-3)16-12(15-11)6-7-18-9-8-17-4/h5-9H2,1-4H3,(H,14,15,16).
What are the key properties of 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine?
6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine has a molecular weight of 253.35 g/mol, XLogP of 1.59, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-[2-(2-methoxyethoxy)ethyl]-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 102928875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).