N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine

C15H19N5O2 — CID 46953409

IUPACN-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine
SMILESCOCCNc1ncc(-c2cnccn2)c(C2CCCO2)n1
InChIInChI=1S/C15H19N5O2/c1-21-8-6-18-15-19-9-11(12-10-16-4-5-17-12)14(20-15)13-3-2-7-22-13/h4-5,9-10,13H,2-3,6-8H2,1H3,(H,18,19,20)
InChIKeyGNMWMEYRINKBRM-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.84
Rot. Bonds6

About N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine

N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine (PubChem CID 46953409) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine
PubChem CID46953409
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC NameN-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine
SMILESCOCCNc1ncc(-c2cnccn2)c(C2CCCO2)n1
InChIInChI=1S/C15H19N5O2/c1-21-8-6-18-15-19-9-11(12-10-16-4-5-17-12)14(20-15)13-3-2-7-22-13/h4-5,9-10,13H,2-3,6-8H2,1H3,(H,18,19,20)
InChIKeyGNMWMEYRINKBRM-UHFFFAOYSA-N
XLogP1.84
TPSA82.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N-(3-ethoxypropyl)-4-[(2R)-oxolan-2-yl]-5-pyrazin-2-ylpyrimidin-2-amine
CID 92593074
N-[(3,4-dimethoxyphenyl)methyl]-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine
CID 46960849
4-[(2S)-oxolan-2-yl]-5-pyridin-4-yl-N-(thiophen-2-ylmethyl)pyrimidin-2-amine
CID 51589156
2-N-(2-methoxyethyl)-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 112885846
N,4-dicyclopropyl-5-pyrazin-2-ylpyrimidin-2-amine
CID 95857494
N-cyclohexyl-2-(2-methoxyethylamino)pyrimidine-5-carboxamide
CID 109250278
N-(2-methoxyethyl)-5-(3-methyl-1,2-oxazol-5-yl)-4-pyridin-4-ylpyrimidin-2-amine
CID 95803036
4-methoxy-N-[2-(oxolan-2-ylmethoxy)ethyl]pyrimidin-2-amine
CID 133315051
5-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-2-amine
CID 63208180
N-(oxan-3-yl)-4-pyrazin-2-ylpyrimidin-2-amine
CID 128559210
5-bromo-4-methoxy-N-(2-methoxyethyl)pyrimidin-2-amine
CID 103726573
2-methoxy-N-[(2-pyridin-3-yloxan-3-yl)methyl]ethanamine
CID 79365670

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine?
The IUPAC name of N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine (CID 46953409) is N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine is COCCNc1ncc(-c2cnccn2)c(C2CCCO2)n1.
What is the InChIKey of N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine?
The InChIKey is GNMWMEYRINKBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-21-8-6-18-15-19-9-11(12-10-16-4-5-17-12)14(20-15)13-3-2-7-22-13/h4-5,9-10,13H,2-3,6-8H2,1H3,(H,18,19,20).
What are the key properties of N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine?
N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine has a molecular weight of 301.35 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-(oxolan-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine is sourced from PubChem (CID 46953409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).