6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine

C13H24N4O — CID 80871813

IUPAC6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine
SMILESCCNc1cc(OCCN(CC)CC)nc(C)n1
InChIInChI=1S/C13H24N4O/c1-5-14-12-10-13(16-11(4)15-12)18-9-8-17(6-2)7-3/h10H,5-9H2,1-4H3,(H,14,15,16)
InChIKeyLCRBCNPGKFHLOS-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.94
Rot. Bonds8

About 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine

6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine (PubChem CID 80871813) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine
PubChem CID80871813
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine
SMILESCCNc1cc(OCCN(CC)CC)nc(C)n1
InChIInChI=1S/C13H24N4O/c1-5-14-12-10-13(16-11(4)15-12)18-9-8-17(6-2)7-3/h10H,5-9H2,1-4H3,(H,14,15,16)
InChIKeyLCRBCNPGKFHLOS-UHFFFAOYSA-N
XLogP1.94
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N',N'-diethyl-N-[6-(2-methoxyethoxy)-2-methylpyrimidin-4-yl]ethane-1,2-diamine
CID 82454422
6-(2-aminoethoxy)-N-ethyl-2-methylpyrimidin-4-amine
CID 121206106
N-ethyl-2-methyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80870434
6-[2-(diethylamino)ethoxy]-2-ethyl-N-propylpyrimidin-4-amine
CID 80942263
2-methyl-6-propoxy-N-propylpyrimidin-4-amine
CID 80866216
2-tert-butyl-6-[2-(diethylamino)ethoxy]-N-methylpyrimidin-4-amine
CID 80963364
6-[2-(diethylamino)ethoxy]-4-N-methylpyrimidine-2,4-diamine
CID 80871216
N',N'-dimethyl-N-(2-methyl-6-propoxypyrimidin-4-yl)propane-1,3-diamine
CID 82454010
N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine
CID 80940196
4-N-[3-(diethylamino)propyl]-4-N,6-N-diethyl-2-methylpyrimidine-4,6-diamine
CID 102998975
6-heptoxy-2-methyl-N-propylpyrimidin-4-amine
CID 80862052
4-N-(6-ethoxy-2-methylpyrimidin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine
CID 66325658

Frequently Asked Questions

What is the IUPAC name of 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine?
The IUPAC name of 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine (CID 80871813) is 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine.
What is the SMILES notation for 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine?
The canonical SMILES for 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine is CCNc1cc(OCCN(CC)CC)nc(C)n1.
What is the InChIKey of 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine?
The InChIKey is LCRBCNPGKFHLOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-5-14-12-10-13(16-11(4)15-12)18-9-8-17(6-2)7-3/h10H,5-9H2,1-4H3,(H,14,15,16).
What are the key properties of 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine?
6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine has a molecular weight of 252.36 g/mol, XLogP of 1.94, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine is sourced from PubChem (CID 80871813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).