5-propyl-6-quinolin-8-yloxypyrimidin-4-amine

C16H16N4O — CID 80874684

IUPAC5-propyl-6-quinolin-8-yloxypyrimidin-4-amine
SMILESCCCc1c(N)ncnc1Oc1cccc2cccnc12
InChIInChI=1S/C16H16N4O/c1-2-5-12-15(17)19-10-20-16(12)21-13-8-3-6-11-7-4-9-18-14(11)13/h3-4,6-10H,2,5H2,1H3,(H2,17,19,20)
InChIKeyRKXYLXHHYSDBBA-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.35
Rot. Bonds4

About 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine

5-propyl-6-quinolin-8-yloxypyrimidin-4-amine (PubChem CID 80874684) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine.

Molecular Properties

Compound Name5-propyl-6-quinolin-8-yloxypyrimidin-4-amine
PubChem CID80874684
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name5-propyl-6-quinolin-8-yloxypyrimidin-4-amine
SMILESCCCc1c(N)ncnc1Oc1cccc2cccnc12
InChIInChI=1S/C16H16N4O/c1-2-5-12-15(17)19-10-20-16(12)21-13-8-3-6-11-7-4-9-18-14(11)13/h3-4,6-10H,2,5H2,1H3,(H2,17,19,20)
InChIKeyRKXYLXHHYSDBBA-UHFFFAOYSA-N
XLogP3.35
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,3-dimethylphenoxy)-5-propylpyrimidin-4-amine
CID 80864705
5-propyl-6-quinolin-7-yloxypyrimidin-4-amine
CID 107315866
6-(2-iodophenoxy)-5-propylpyrimidin-4-amine
CID 80875866
6-(2,4-dimethylphenoxy)-5-propylpyrimidin-4-amine
CID 80862753
4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine
CID 19141825
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-propylpyrimidin-4-amine
CID 103176311
5-propyl-6-(4-propylphenoxy)pyrimidin-4-amine
CID 80880474
6-(4-bromophenoxy)-5-propylpyrimidin-4-amine
CID 80864434
4-quinolin-8-yloxy-6-quinolin-8-ylsulfanylpyrimidin-5-amine
CID 19141886
8-(5-nitro-6-quinolin-8-yloxypyrimidin-4-yl)oxyquinoline
CID 23493774
6-(2-fluoro-5-methylphenoxy)-5-propylpyrimidin-4-amine
CID 80878010
4-N-prop-2-enyl-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19135970

Frequently Asked Questions

What is the IUPAC name of 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
The IUPAC name of 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine (CID 80874684) is 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine.
What is the SMILES notation for 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
The canonical SMILES for 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine is CCCc1c(N)ncnc1Oc1cccc2cccnc12.
What is the InChIKey of 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
The InChIKey is RKXYLXHHYSDBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-2-5-12-15(17)19-10-20-16(12)21-13-8-3-6-11-7-4-9-18-14(11)13/h3-4,6-10H,2,5H2,1H3,(H2,17,19,20).
What are the key properties of 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
5-propyl-6-quinolin-8-yloxypyrimidin-4-amine has a molecular weight of 280.33 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-6-quinolin-8-yloxypyrimidin-4-amine is sourced from PubChem (CID 80874684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).