N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine

C15H20N4 — CID 81312552

IUPACN-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NCC)nc(-c2ccc(C)cn2)n1
InChIInChI=1S/C15H20N4/c1-4-6-12-9-14(16-5-2)19-15(18-12)13-8-7-11(3)10-17-13/h7-10H,4-6H2,1-3H3,(H,16,18,19)
InChIKeyVBJCZKPYNWISQX-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.23
Rot. Bonds5

About N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine

N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine (PubChem CID 81312552) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine
PubChem CID81312552
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NCC)nc(-c2ccc(C)cn2)n1
InChIInChI=1S/C15H20N4/c1-4-6-12-9-14(16-5-2)19-15(18-12)13-8-7-11(3)10-17-13/h7-10H,4-6H2,1-3H3,(H,16,18,19)
InChIKeyVBJCZKPYNWISQX-UHFFFAOYSA-N
XLogP3.23
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 ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine?
The IUPAC name of N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine (CID 81312552) is N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine is CCCc1cc(NCC)nc(-c2ccc(C)cn2)n1.
What is the InChIKey of N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine?
The InChIKey is VBJCZKPYNWISQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-4-6-12-9-14(16-5-2)19-15(18-12)13-8-7-11(3)10-17-13/h7-10H,4-6H2,1-3H3,(H,16,18,19).
What are the key properties of N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine?
N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-methyl-2-pyridinyl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 81312552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).