4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine

C16H16N4O2 — CID 19141825

IUPAC4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine
SMILESCC(C)Oc1ncnc(Oc2cccc3cccnc23)c1N
InChIInChI=1S/C16H16N4O2/c1-10(2)21-15-13(17)16(20-9-19-15)22-12-7-3-5-11-6-4-8-18-14(11)12/h3-10H,17H2,1-2H3
InChIKeyQHGXQZPJYPCWHI-UHFFFAOYSA-N
MW296.33 g/mol
LogP3.19
Rot. Bonds4

About 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine

4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine (PubChem CID 19141825) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine.

Molecular Properties

Compound Name4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine
PubChem CID19141825
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine
SMILESCC(C)Oc1ncnc(Oc2cccc3cccnc23)c1N
InChIInChI=1S/C16H16N4O2/c1-10(2)21-15-13(17)16(20-9-19-15)22-12-7-3-5-11-6-4-8-18-14(11)12/h3-10H,17H2,1-2H3
InChIKeyQHGXQZPJYPCWHI-UHFFFAOYSA-N
XLogP3.19
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-quinolin-8-yloxy-6-quinolin-8-ylsulfanylpyrimidin-5-amine
CID 19141886
4-N-(3-methylbutyl)-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19141836
4-N-(4-propan-2-ylphenyl)-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 22547806
4-(4-chloro-3-methylphenoxy)-6-quinolin-8-yloxypyrimidin-5-amine
CID 19141838
4-N-prop-2-enyl-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19135970
4-N-cycloheptyl-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19141861
4-N-cyclohexyl-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19135779
N'-(5-amino-6-quinolin-8-yloxypyrimidin-4-yl)-2,2-diphenylacetohydrazide
CID 19141820
5-propyl-6-quinolin-8-yloxypyrimidin-4-amine
CID 80874684
4-N-(2-bromophenyl)-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19141774
8-(5-nitro-6-quinolin-8-yloxypyrimidin-4-yl)oxyquinoline
CID 23493774
4-N-(5-chloro-2-pyridinyl)-6-quinolin-8-yloxypyrimidine-4,5-diamine
CID 19141766

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine?
The IUPAC name of 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine (CID 19141825) is 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine.
What is the SMILES notation for 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine?
The canonical SMILES for 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine is CC(C)Oc1ncnc(Oc2cccc3cccnc23)c1N.
What is the InChIKey of 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine?
The InChIKey is QHGXQZPJYPCWHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-10(2)21-15-13(17)16(20-9-19-15)22-12-7-3-5-11-6-4-8-18-14(11)12/h3-10H,17H2,1-2H3.
What are the key properties of 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine?
4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine has a molecular weight of 296.33 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yloxy-6-quinolin-8-yloxypyrimidin-5-amine is sourced from PubChem (CID 19141825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).