5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine

C15H20N4 — CID 79740521

IUPAC5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine
SMILESCCc1ccc(Cc2ncnc(NC)c2CC)nc1
InChIInChI=1S/C15H20N4/c1-4-11-6-7-12(17-9-11)8-14-13(5-2)15(16-3)19-10-18-14/h6-7,9-10H,4-5,8H2,1-3H3,(H,16,18,19)
InChIKeyGCTCQGFUWXGHNT-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.63
Rot. Bonds5

About 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine

5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine (PubChem CID 79740521) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine
PubChem CID79740521
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine
SMILESCCc1ccc(Cc2ncnc(NC)c2CC)nc1
InChIInChI=1S/C15H20N4/c1-4-11-6-7-12(17-9-11)8-14-13(5-2)15(16-3)19-10-18-14/h6-7,9-10H,4-5,8H2,1-3H3,(H,16,18,19)
InChIKeyGCTCQGFUWXGHNT-UHFFFAOYSA-N
XLogP2.63
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine (CID 79740521) is 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine is CCc1ccc(Cc2ncnc(NC)c2CC)nc1.
What is the InChIKey of 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine?
The InChIKey is GCTCQGFUWXGHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-4-11-6-7-12(17-9-11)8-14-13(5-2)15(16-3)19-10-18-14/h6-7,9-10H,4-5,8H2,1-3H3,(H,16,18,19).
What are the key properties of 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine?
5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-[(5-ethyl-2-pyridinyl)methyl]-N-methylpyrimidin-4-amine is sourced from PubChem (CID 79740521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).