5-propyl-6-quinolin-7-yloxypyrimidin-4-amine

C16H16N4O — CID 107315866

IUPAC5-propyl-6-quinolin-7-yloxypyrimidin-4-amine
SMILESCCCc1c(N)ncnc1Oc1ccc2cccnc2c1
InChIInChI=1S/C16H16N4O/c1-2-4-13-15(17)19-10-20-16(13)21-12-7-6-11-5-3-8-18-14(11)9-12/h3,5-10H,2,4H2,1H3,(H2,17,19,20)
InChIKeyKAHMSFCEJPPCMF-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.35
Rot. Bonds4

About 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine

5-propyl-6-quinolin-7-yloxypyrimidin-4-amine (PubChem CID 107315866) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine.

Molecular Properties

Compound Name5-propyl-6-quinolin-7-yloxypyrimidin-4-amine
PubChem CID107315866
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name5-propyl-6-quinolin-7-yloxypyrimidin-4-amine
SMILESCCCc1c(N)ncnc1Oc1ccc2cccnc2c1
InChIInChI=1S/C16H16N4O/c1-2-4-13-15(17)19-10-20-16(13)21-12-7-6-11-5-3-8-18-14(11)9-12/h3,5-10H,2,4H2,1H3,(H2,17,19,20)
InChIKeyKAHMSFCEJPPCMF-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

Analyze 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-(6-chloro-5-ethylpyrimidin-4-yl)oxyquinoline
CID 107313613
5-propyl-6-quinolin-8-yloxypyrimidin-4-amine
CID 80874684
5-propyl-6-(4-propylphenoxy)pyrimidin-4-amine
CID 80880474
6-(4-bromophenoxy)-5-propylpyrimidin-4-amine
CID 80864434
5-(methoxyiminomethyl)-6-quinolin-7-yloxypyrimidin-4-amine
CID 74077314
6-[3-(methoxymethyl)phenoxy]-5-propylpyrimidin-4-amine
CID 80876347
2-quinolin-7-yloxypyridin-3-amine
CID 107313182
6-(4-bromo-3,5-dimethylphenoxy)-5-propylpyrimidin-4-amine
CID 107727376
6-(4-chloro-3,5-dimethylphenoxy)-5-propylpyrimidin-4-amine
CID 80874729
6-(2-bromo-4-methoxyphenoxy)-5-propylpyrimidin-4-amine
CID 104708785
(5-methoxy-6-quinolin-7-yloxypyrimidin-4-yl)hydrazine
CID 107315958
7-(5-bromo-6-chloropyrimidin-4-yl)oxyquinoline
CID 114071649

Frequently Asked Questions

What is the IUPAC name of 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine?
The IUPAC name of 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine (CID 107315866) is 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine.
What is the SMILES notation for 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine?
The canonical SMILES for 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine is CCCc1c(N)ncnc1Oc1ccc2cccnc2c1.
What is the InChIKey of 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine?
The InChIKey is KAHMSFCEJPPCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-2-4-13-15(17)19-10-20-16(13)21-12-7-6-11-5-3-8-18-14(11)9-12/h3,5-10H,2,4H2,1H3,(H2,17,19,20).
What are the key properties of 5-propyl-6-quinolin-7-yloxypyrimidin-4-amine?
5-propyl-6-quinolin-7-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-7-yloxypyrimidin-4-amine is sourced from PubChem (CID 107315866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).