6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine

C15H20N4 — CID 80936486

IUPAC6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1nc(NC)cc(-c2ccc(N(C)C)cc2)n1
InChIInChI=1S/C15H20N4/c1-5-14-17-13(10-15(16-2)18-14)11-6-8-12(9-7-11)19(3)4/h6-10H,5H2,1-4H3,(H,16,17,18)
InChIKeyGRCGUAKOTBNQEW-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.81
Rot. Bonds4

About 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine

6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine (PubChem CID 80936486) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine
PubChem CID80936486
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1nc(NC)cc(-c2ccc(N(C)C)cc2)n1
InChIInChI=1S/C15H20N4/c1-5-14-17-13(10-15(16-2)18-14)11-6-8-12(9-7-11)19(3)4/h6-10H,5H2,1-4H3,(H,16,17,18)
InChIKeyGRCGUAKOTBNQEW-UHFFFAOYSA-N
XLogP2.81
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine?
The IUPAC name of 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine (CID 80936486) is 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine is CCc1nc(NC)cc(-c2ccc(N(C)C)cc2)n1.
What is the InChIKey of 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine?
The InChIKey is GRCGUAKOTBNQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-5-14-17-13(10-15(16-2)18-14)11-6-8-12(9-7-11)19(3)4/h6-10H,5H2,1-4H3,(H,16,17,18).
What are the key properties of 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine?
6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(dimethylamino)phenyl]-2-ethyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 80936486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).