6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine

C17H18N4 — CID 81230922

IUPAC6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCc1ccc2cc(-c3ncnc(N)c3C(C)C)ccc2n1
InChIInChI=1S/C17H18N4/c1-10(2)15-16(19-9-20-17(15)18)13-6-7-14-12(8-13)5-4-11(3)21-14/h4-10H,1-3H3,(H2,18,19,20)
InChIKeyGBZZSYNZELYPTF-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.71
Rot. Bonds2

About 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine

6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 81230922) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID81230922
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC Name6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCc1ccc2cc(-c3ncnc(N)c3C(C)C)ccc2n1
InChIInChI=1S/C17H18N4/c1-10(2)15-16(19-9-20-17(15)18)13-6-7-14-12(8-13)5-4-11(3)21-14/h4-10H,1-3H3,(H2,18,19,20)
InChIKeyGBZZSYNZELYPTF-UHFFFAOYSA-N
XLogP3.71
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-methylquinolin-6-yl)-3-propan-2-ylimidazol-4-amine
CID 105379309
2,5-dimethyl-6-(2-methylquinolin-6-yl)pyrimidin-4-amine
CID 81221971
2,3-dimethyl-5-(2-methylquinolin-6-yl)imidazol-4-amine
CID 105379314
2,5-difluoro-4-(2-methylquinolin-6-yl)aniline
CID 107615923
2-(2-methylquinolin-6-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 105379360
2-methyl-6-(2-methyl-3-pyridinyl)quinoline
CID 90167611
3-chloro-4-(2-methylquinolin-6-yl)-1,2,5-thiadiazole
CID 81221409
3-(2-methylquinolin-6-yl)-1H-pyrazine-2-thione
CID 106519588
6-(4-methylpyrimidin-2-yl)sulfanyl-5-propan-2-ylpyrimidin-4-amine
CID 80891671
(2-methylquinolin-6-yl)methanethiol
CID 105379811
3-(2-ethoxyquinolin-6-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 122442388
2-methyl-6-naphthalen-1-ylquinoline
CID 58099181

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine (CID 81230922) is 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine is Cc1ccc2cc(-c3ncnc(N)c3C(C)C)ccc2n1.
What is the InChIKey of 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is GBZZSYNZELYPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-10(2)15-16(19-9-20-17(15)18)13-6-7-14-12(8-13)5-4-11(3)21-14/h4-10H,1-3H3,(H2,18,19,20).
What are the key properties of 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine?
6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylquinolin-6-yl)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 81230922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).