4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine

C11H15N5 — CID 80854046

IUPAC4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(-n2ccnc2)n1
InChIInChI=1S/C11H15N5/c1-3-4-13-11-14-9(2)7-10(15-11)16-6-5-12-8-16/h5-8H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyXFYKILWCTFMKMA-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.79
Rot. Bonds4

About 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine

4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine (PubChem CID 80854046) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine
PubChem CID80854046
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(-n2ccnc2)n1
InChIInChI=1S/C11H15N5/c1-3-4-13-11-14-9(2)7-10(15-11)16-6-5-12-8-16/h5-8H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyXFYKILWCTFMKMA-UHFFFAOYSA-N
XLogP1.79
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-propyl-6-(1,2,4-triazol-1-yl)pyrimidin-2-amine
CID 80853223
6-imidazol-1-yl-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719533
6-imidazol-1-yl-N-propylpyridin-3-amine
CID 43710767
4-methyl-6-piperazin-1-yl-N-propylpyrimidin-2-amine
CID 80837570
4-imidazol-1-yl-6-(2-methylpropylsulfanyl)-N-propyl-1,3,5-triazin-2-amine
CID 80893406
4-(3,5-dimethylpiperidin-1-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80766891
4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80831413
6-imidazol-1-yl-2-N-pentan-2-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80751147
2-[[4-imidazol-1-yl-6-(propylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropan-1-ol
CID 80773574
4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine
CID 80792256
3-[[4-imidazol-1-yl-6-(propylamino)-1,3,5-triazin-2-yl]amino]propane-1,2-diol
CID 80832648
4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine
CID 80835884

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine?
The IUPAC name of 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine (CID 80854046) is 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine is CCCNc1nc(C)cc(-n2ccnc2)n1.
What is the InChIKey of 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine?
The InChIKey is XFYKILWCTFMKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-3-4-13-11-14-9(2)7-10(15-11)16-6-5-12-8-16/h5-8H,3-4H2,1-2H3,(H,13,14,15).
What are the key properties of 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine?
4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine has a molecular weight of 217.28 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-6-methyl-N-propylpyrimidin-2-amine is sourced from PubChem (CID 80854046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).