2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine

C14H18N4 — CID 116893024

IUPAC2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine
SMILESCc1cc(-c2cccnc2)nc(CC(C)CN)n1
InChIInChI=1S/C14H18N4/c1-10(8-15)6-14-17-11(2)7-13(18-14)12-4-3-5-16-9-12/h3-5,7,9-10H,6,8,15H2,1-2H3
InChIKeyYLUZXRBWBJFXIL-UHFFFAOYSA-N
MW242.33 g/mol
LogP1.98
Rot. Bonds4

About 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine

2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine (PubChem CID 116893024) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine
PubChem CID116893024
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine
SMILESCc1cc(-c2cccnc2)nc(CC(C)CN)n1
InChIInChI=1S/C14H18N4/c1-10(8-15)6-14-17-11(2)7-13(18-14)12-4-3-5-16-9-12/h3-5,7,9-10H,6,8,15H2,1-2H3
InChIKeyYLUZXRBWBJFXIL-UHFFFAOYSA-N
XLogP1.98
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-2-(2-methylpropyl)-6-phenylpyrimidine
CID 70659256
3-methyl-2-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)butan-1-ol
CID 116896453
1-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)ethanone
CID 116895387
4,6-dimethyl-2-pyridin-3-ylpyrimidine
CID 55218547
4-methyl-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 121360262
3-methyl-6-pyridin-3-ylpyridazine
CID 89161646
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
2-methyl-6-pyridin-3-ylpyridine;propane
CID 144615785
1-[4-methyl-6-(1H-pyrrol-3-yl)pyrimidin-2-yl]propan-2-amine
CID 116892762
1-(6-pyridin-3-ylpyrimidin-4-yl)propan-2-amine
CID 83849087
[3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)oxetan-3-yl]methanol
CID 116896302
ethane;2-methyl-6-pyridin-3-ylpyridine
CID 144687863

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine?
The IUPAC name of 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine (CID 116893024) is 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine.
What is the SMILES notation for 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine?
The canonical SMILES for 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine is Cc1cc(-c2cccnc2)nc(CC(C)CN)n1.
What is the InChIKey of 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine?
The InChIKey is YLUZXRBWBJFXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-10(8-15)6-14-17-11(2)7-13(18-14)12-4-3-5-16-9-12/h3-5,7,9-10H,6,8,15H2,1-2H3.
What are the key properties of 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine?
2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine has a molecular weight of 242.33 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(4-methyl-6-pyridin-3-ylpyrimidin-2-yl)propan-1-amine is sourced from PubChem (CID 116893024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).