2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine

C15H27N3O — CID 106815334

IUPAC2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(CC(C)C)nc(CCOCC)n1
InChIInChI=1S/C15H27N3O/c1-5-8-16-15-11-13(10-12(3)4)17-14(18-15)7-9-19-6-2/h11-12H,5-10H2,1-4H3,(H,16,17,18)
InChIKeyHOAQXEYMYIHPES-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.08
Rot. Bonds9

About 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine

2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine (PubChem CID 106815334) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
PubChem CID106815334
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(CC(C)C)nc(CCOCC)n1
InChIInChI=1S/C15H27N3O/c1-5-8-16-15-11-13(10-12(3)4)17-14(18-15)7-9-19-6-2/h11-12H,5-10H2,1-4H3,(H,16,17,18)
InChIKeyHOAQXEYMYIHPES-UHFFFAOYSA-N
XLogP3.08
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-methoxyethoxy)ethyl]-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine
CID 102928942
2-[2-(2-methoxyethoxy)ethyl]-6-(methoxymethyl)-N-propylpyrimidin-4-amine
CID 102928862
2-(2-ethoxyethyl)-N-propylpyrimidin-4-amine
CID 106815248
2-butyl-6-ethyl-N-propylpyrimidin-4-amine
CID 79413331
2-[2-(2,2-difluoroethoxy)ethyl]-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 103150314
4-N-(2-ethoxyethyl)-4-N-ethyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80942751
2-(ethoxymethyl)-4-N-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 113401286
4-N-(3-ethoxypropyl)-2-propylpyrimidine-4,6-diamine
CID 80946334
6-tert-butyl-2-(2-methoxyethyl)-N-propylpyrimidin-4-amine
CID 62192335
6-cyclopropyl-2-(3-methylbutyl)-N-propylpyrimidin-4-amine
CID 63354181
4-N-(2,3-dimethylbutyl)-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80949730
2-[2-(dimethylamino)ethyl]-N,6-dipropylpyrimidin-4-amine
CID 115346995

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine (CID 106815334) is 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine is CCCNc1cc(CC(C)C)nc(CCOCC)n1.
What is the InChIKey of 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
The InChIKey is HOAQXEYMYIHPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-5-8-16-15-11-13(10-12(3)4)17-14(18-15)7-9-19-6-2/h11-12H,5-10H2,1-4H3,(H,16,17,18).
What are the key properties of 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine?
2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine has a molecular weight of 265.40 g/mol, XLogP of 3.08, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 106815334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).