2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine

C15H20N4 — CID 131943928

IUPAC2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine
SMILESCc1cccc(CC(C)Nc2nc(C)ncc2C)n1
InChIInChI=1S/C15H20N4/c1-10-9-16-13(4)19-15(10)18-12(3)8-14-7-5-6-11(2)17-14/h5-7,9,12H,8H2,1-4H3,(H,16,18,19)
InChIKeyCLUAAPJSQMBMFK-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.84
Rot. Bonds4

About 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine

2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine (PubChem CID 131943928) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine
PubChem CID131943928
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine
SMILESCc1cccc(CC(C)Nc2nc(C)ncc2C)n1
InChIInChI=1S/C15H20N4/c1-10-9-16-13(4)19-15(10)18-12(3)8-14-7-5-6-11(2)17-14/h5-7,9,12H,8H2,1-4H3,(H,16,18,19)
InChIKeyCLUAAPJSQMBMFK-UHFFFAOYSA-N
XLogP2.84
TPSA50.70 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 ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine?
The IUPAC name of 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine (CID 131943928) is 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine.
What is the SMILES notation for 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine?
The canonical SMILES for 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine is Cc1cccc(CC(C)Nc2nc(C)ncc2C)n1.
What is the InChIKey of 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine?
The InChIKey is CLUAAPJSQMBMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-9-16-13(4)19-15(10)18-12(3)8-14-7-5-6-11(2)17-14/h5-7,9,12H,8H2,1-4H3,(H,16,18,19).
What are the key properties of 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine?
2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]pyrimidin-4-amine is sourced from PubChem (CID 131943928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).