6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine

C15H28N4O — CID 80937326

IUPAC6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(OCC(C)(C)N(C)C)nc(CC)n1
InChIInChI=1S/C15H28N4O/c1-7-9-16-13-10-14(18-12(8-2)17-13)20-11-15(3,4)19(5)6/h10H,7-9,11H2,1-6H3,(H,16,17,18)
InChIKeyXPPFNPADRZTUQV-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.58
Rot. Bonds8

About 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine

6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine (PubChem CID 80937326) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine
PubChem CID80937326
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC Name6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(OCC(C)(C)N(C)C)nc(CC)n1
InChIInChI=1S/C15H28N4O/c1-7-9-16-13-10-14(18-12(8-2)17-13)20-11-15(3,4)19(5)6/h10H,7-9,11H2,1-6H3,(H,16,17,18)
InChIKeyXPPFNPADRZTUQV-UHFFFAOYSA-N
XLogP2.58
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethyl-6-(3-methoxy-3-methylbutoxy)-N-propylpyrimidin-4-amine
CID 106669067
6-[2-(diethylamino)ethoxy]-2-ethyl-N-propylpyrimidin-4-amine
CID 80942263
2-ethyl-6-(3-methoxypropoxy)-N-propylpyrimidin-4-amine
CID 80941336
N-(2-ethyl-6-propoxypyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 82454057
N,2-diethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine
CID 80942434
2-ethyl-6-pentan-2-yloxy-N-propylpyrimidin-4-amine
CID 102989348
N-(2-ethyl-6-methoxypyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 82453730
2-(methoxymethyl)-6-propoxy-N-propylpyrimidin-4-amine
CID 113401645
6-[3-(dimethylamino)propoxy]-N,2-diethylpyrimidin-4-amine
CID 80941359
4-N-(2-ethoxyethyl)-2-ethyl-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 81068419
2-ethyl-6-N-propyl-4-N-(3,3,3-trifluoropropyl)pyrimidine-4,6-diamine
CID 80935134
2-ethyl-4-N-methyl-4-N-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80933924

Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine (CID 80937326) is 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine is CCCNc1cc(OCC(C)(C)N(C)C)nc(CC)n1.
What is the InChIKey of 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine?
The InChIKey is XPPFNPADRZTUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-7-9-16-13-10-14(18-12(8-2)17-13)20-11-15(3,4)19(5)6/h10H,7-9,11H2,1-6H3,(H,16,17,18).
What are the key properties of 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine?
6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine has a molecular weight of 280.42 g/mol, XLogP of 2.58, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)-2-methylpropoxy]-2-ethyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80937326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).