2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine

C16H22N4 — CID 79220285

IUPAC2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine
SMILESCCc1nc(-c2cc(C)ccn2)nc(CC)c1CCN
InChIInChI=1S/C16H22N4/c1-4-13-12(6-8-17)14(5-2)20-16(19-13)15-10-11(3)7-9-18-15/h7,9-10H,4-6,8,17H2,1-3H3
InChIKeyWZDOIWIILXMEKF-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.47
Rot. Bonds5

About 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine

2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine (PubChem CID 79220285) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine.

Molecular Properties

Compound Name2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine
PubChem CID79220285
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine
SMILESCCc1nc(-c2cc(C)ccn2)nc(CC)c1CCN
InChIInChI=1S/C16H22N4/c1-4-13-12(6-8-17)14(5-2)20-16(19-13)15-10-11(3)7-9-18-15/h7,9-10H,4-6,8,17H2,1-3H3
InChIKeyWZDOIWIILXMEKF-UHFFFAOYSA-N
XLogP2.47
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine?
The IUPAC name of 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine (CID 79220285) is 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine.
What is the SMILES notation for 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine?
The canonical SMILES for 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine is CCc1nc(-c2cc(C)ccn2)nc(CC)c1CCN.
What is the InChIKey of 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine?
The InChIKey is WZDOIWIILXMEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-4-13-12(6-8-17)14(5-2)20-16(19-13)15-10-11(3)7-9-18-15/h7,9-10H,4-6,8,17H2,1-3H3.
What are the key properties of 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine?
2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine has a molecular weight of 270.38 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,6-diethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]ethanamine is sourced from PubChem (CID 79220285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).