4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine

C16H17N5 — CID 114755549

IUPAC4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCc1cc(-c2nc(N)nc(C(C)C)n2)nc2ccccc12
InChIInChI=1S/C16H17N5/c1-9(2)14-19-15(21-16(17)20-14)13-8-10(3)11-6-4-5-7-12(11)18-13/h4-9H,1-3H3,(H2,17,19,20,21)
InChIKeySMIFONNFXXDYSW-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.10
Rot. Bonds2

About 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine

4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 114755549) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID114755549
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCc1cc(-c2nc(N)nc(C(C)C)n2)nc2ccccc12
InChIInChI=1S/C16H17N5/c1-9(2)14-19-15(21-16(17)20-14)13-8-10(3)11-6-4-5-7-12(11)18-13/h4-9H,1-3H3,(H2,17,19,20,21)
InChIKeySMIFONNFXXDYSW-UHFFFAOYSA-N
XLogP3.10
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-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

4-methyl-6-(4-methylquinolin-2-yl)-1,3,5-triazin-2-amine
CID 114755546
4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868472
4-propan-2-yl-6-pyridin-2-yl-1,3,5-triazin-2-amine
CID 63868334
2-(4-methylquinolin-2-yl)pyrimidin-4-amine
CID 114755416
(1S)-1-[4-methyl-2-(4-methylquinolin-2-yl)pyrimidin-5-yl]ethanamine
CID 103432065
2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine
CID 114755413
4-(2-bromophenyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63867300
2-(4-methylquinolin-2-yl)benzenethiol
CID 136656831
4-(3-methyl-2-pyridinyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868866
4-methyl-2-(2,3,4,5-tetramethylphenyl)quinoline
CID 59348556
1-[2-(4-methylquinolin-2-yl)pyrimidin-4-yl]propan-2-amine
CID 114755499
(1R)-1-[4-methyl-2-(4-methylquinolin-2-yl)pyrimidin-5-yl]ethanol
CID 103431263

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine (CID 114755549) is 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine is Cc1cc(-c2nc(N)nc(C(C)C)n2)nc2ccccc12.
What is the InChIKey of 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is SMIFONNFXXDYSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c1-9(2)14-19-15(21-16(17)20-14)13-8-10(3)11-6-4-5-7-12(11)18-13/h4-9H,1-3H3,(H2,17,19,20,21).
What are the key properties of 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine?
4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 279.35 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 114755549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).