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

C16H16N4O — CID 80874681

IUPACN-propyl-6-quinolin-8-yloxypyrimidin-4-amine
SMILESCCCNc1cc(Oc2cccc3cccnc23)ncn1
InChIInChI=1S/C16H16N4O/c1-2-8-17-14-10-15(20-11-19-14)21-13-7-3-5-12-6-4-9-18-16(12)13/h3-7,9-11H,2,8H2,1H3,(H,17,19,20)
InChIKeyGVEZOPSXMKXLDD-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.64
Rot. Bonds5

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

N-propyl-6-quinolin-8-yloxypyrimidin-4-amine (PubChem CID 80874681) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is N-propyl-6-quinolin-8-yloxypyrimidin-4-amine.

Molecular Properties

Compound NameN-propyl-6-quinolin-8-yloxypyrimidin-4-amine
PubChem CID80874681
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC NameN-propyl-6-quinolin-8-yloxypyrimidin-4-amine
SMILESCCCNc1cc(Oc2cccc3cccnc23)ncn1
InChIInChI=1S/C16H16N4O/c1-2-8-17-14-10-15(20-11-19-14)21-13-7-3-5-12-6-4-9-18-16(12)13/h3-7,9-11H,2,8H2,1H3,(H,17,19,20)
InChIKeyGVEZOPSXMKXLDD-UHFFFAOYSA-N
XLogP3.64
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-propyl-6-quinolin-8-yloxypyridin-2-amine
CID 80874687
N-propyl-6-quinolin-8-yloxypyrazin-2-amine
CID 80874686
2-[6-(propylamino)pyrimidin-4-yl]oxybenzonitrile
CID 80862938
6-(2-nitrophenoxy)-N-propylpyrimidin-4-amine
CID 80875228
2-ethyl-N-methyl-6-quinolin-8-yloxypyrimidin-4-amine
CID 80938865
N-methyl-6-quinolin-8-yloxypyridin-2-amine
CID 80881760
8-(6-naphthalen-2-yloxypyrimidin-4-yl)oxyquinoline
CID 126961639
6-(3-propan-2-ylphenoxy)-N-propylpyrimidin-4-amine
CID 80863993
6-(4-bromo-2-fluorophenoxy)-N-propylpyrimidin-4-amine
CID 80881442
N-methyl-1-(6-quinolin-8-yloxy-2-pyridinyl)methanamine
CID 62321854
6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-N-propylpyrimidin-4-amine
CID 106598602
[6-(2-methylquinolin-8-yl)oxypyrimidin-4-yl]hydrazine
CID 80917031

Frequently Asked Questions

What is the IUPAC name of N-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
The IUPAC name of N-propyl-6-quinolin-8-yloxypyrimidin-4-amine (CID 80874681) is N-propyl-6-quinolin-8-yloxypyrimidin-4-amine.
What is the SMILES notation for N-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
The canonical SMILES for N-propyl-6-quinolin-8-yloxypyrimidin-4-amine is CCCNc1cc(Oc2cccc3cccnc23)ncn1.
What is the InChIKey of N-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
The InChIKey is GVEZOPSXMKXLDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-2-8-17-14-10-15(20-11-19-14)21-13-7-3-5-12-6-4-9-18-16(12)13/h3-7,9-11H,2,8H2,1H3,(H,17,19,20).
What are the key properties of N-propyl-6-quinolin-8-yloxypyrimidin-4-amine?
N-propyl-6-quinolin-8-yloxypyrimidin-4-amine has a molecular weight of 280.33 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-6-quinolin-8-yloxypyrimidin-4-amine is sourced from PubChem (CID 80874681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).