N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine

C17H18N4 — CID 114755419

IUPACN-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine
SMILESCCNc1cc(C)nc(-c2cc(C)c3ccccc3n2)n1
InChIInChI=1S/C17H18N4/c1-4-18-16-10-12(3)19-17(21-16)15-9-11(2)13-7-5-6-8-14(13)20-15/h5-10H,4H2,1-3H3,(H,18,19,21)
InChIKeySPDISVXHWFIENF-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.74
Rot. Bonds3

About N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine

N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine (PubChem CID 114755419) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine
PubChem CID114755419
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC NameN-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine
SMILESCCNc1cc(C)nc(-c2cc(C)c3ccccc3n2)n1
InChIInChI=1S/C17H18N4/c1-4-18-16-10-12(3)19-17(21-16)15-9-11(2)13-7-5-6-8-14(13)20-15/h5-10H,4H2,1-3H3,(H,18,19,21)
InChIKeySPDISVXHWFIENF-UHFFFAOYSA-N
XLogP3.74
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-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

6-methyl-2-(4-methylquinolin-2-yl)pyrimidine-4-carbaldehyde
CID 114755476
N-ethyl-6-methyl-2-pyrazin-2-ylpyrimidin-4-amine
CID 62193018
2-(4,6-dichloro-5-ethylpyrimidin-2-yl)-4-methylquinoline
CID 114754592
2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine
CID 114755413
2-benzyl-N-ethyl-6-methylpyrimidin-4-amine
CID 62191071
N-ethyl-2-(5-fluoro-2-pyridinyl)-6-methylpyrimidin-4-amine
CID 79718153
N-ethyl-2-(furan-2-yl)-6-methylpyrimidin-4-amine
CID 62201507
2-(2,6-diethylphenyl)-4-methylquinoline
CID 101498276
4-methyl-6-(4-methylquinolin-2-yl)-1,3,5-triazin-2-amine
CID 114755546
N-ethyl-6-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-amine
CID 62190978
2-(4-bromo-3-methylphenyl)-N-ethyl-6-methylpyrimidin-4-amine
CID 66481080
N-ethyl-6-methyl-2-(2-nitrophenyl)pyrimidin-4-amine
CID 62191593

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine (CID 114755419) is N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine is CCNc1cc(C)nc(-c2cc(C)c3ccccc3n2)n1.
What is the InChIKey of N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine?
The InChIKey is SPDISVXHWFIENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-4-18-16-10-12(3)19-17(21-16)15-9-11(2)13-7-5-6-8-14(13)20-15/h5-10H,4H2,1-3H3,(H,18,19,21).
What are the key properties of N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine?
N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 114755419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).