N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine

C17H22N4 — CID 79722748

IUPACN-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine
SMILESCCCc1c(NC)ncnc1C1CCCc2cccnc21
InChIInChI=1S/C17H22N4/c1-3-6-14-16(20-11-21-17(14)18-2)13-9-4-7-12-8-5-10-19-15(12)13/h5,8,10-11,13H,3-4,6-7,9H2,1-2H3,(H,18,20,21)
InChIKeyDRTIIAIPEJYDIO-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.33
Rot. Bonds4

About N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine

N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine (PubChem CID 79722748) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine
PubChem CID79722748
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC NameN-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine
SMILESCCCc1c(NC)ncnc1C1CCCc2cccnc21
InChIInChI=1S/C17H22N4/c1-3-6-14-16(20-11-21-17(14)18-2)13-9-4-7-12-8-5-10-19-15(12)13/h5,8,10-11,13H,3-4,6-7,9H2,1-2H3,(H,18,20,21)
InChIKeyDRTIIAIPEJYDIO-UHFFFAOYSA-N
XLogP3.33
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-5-propylpyrimidin-4-amine
CID 79739685
6-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 79739582
N-propyl-4-(5,6,7,8-tetrahydroquinolin-8-yl)-1,2,5-thiadiazol-3-amine
CID 79739368
7-(6-chloro-5-ethylpyrimidin-4-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 79739769
5-methyl-2-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine
CID 80974971
N-methyl-2-(5,6,7,8-tetrahydroquinolin-8-yl)pyridin-4-amine
CID 102824855
N-ethyl-2-(5,6,7,8-tetrahydroquinolin-8-yl)pyridin-4-amine
CID 102824856
N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine
CID 79739278
N-[[4-fluoro-3-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]ethanamine
CID 79721454
(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 58985331
4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methylphthalazin-1-amine
CID 79722455
1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine?
The IUPAC name of N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine (CID 79722748) is N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine.
What is the SMILES notation for N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine?
The canonical SMILES for N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine is CCCc1c(NC)ncnc1C1CCCc2cccnc21.
What is the InChIKey of N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine?
The InChIKey is DRTIIAIPEJYDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-3-6-14-16(20-11-21-17(14)18-2)13-9-4-7-12-8-5-10-19-15(12)13/h5,8,10-11,13H,3-4,6-7,9H2,1-2H3,(H,18,20,21).
What are the key properties of N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine?
N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-propyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyrimidin-4-amine is sourced from PubChem (CID 79722748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).