N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine

C17H22N4 — CID 62202397

IUPACN-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine
SMILESCCNc1cc(C)nc(-c2ccc3c(c2)CCCN3C)n1
InChIInChI=1S/C17H22N4/c1-4-18-16-10-12(2)19-17(20-16)14-7-8-15-13(11-14)6-5-9-21(15)3/h7-8,10-11H,4-6,9H2,1-3H3,(H,18,19,20)
InChIKeyXAFYOXRGUQKXGT-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.27
Rot. Bonds3

About N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine

N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine (PubChem CID 62202397) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine
PubChem CID62202397
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC NameN-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine
SMILESCCNc1cc(C)nc(-c2ccc3c(c2)CCCN3C)n1
InChIInChI=1S/C17H22N4/c1-4-18-16-10-12(2)19-17(20-16)14-7-8-15-13(11-14)6-5-9-21(15)3/h7-8,10-11H,4-6,9H2,1-3H3,(H,18,19,20)
InChIKeyXAFYOXRGUQKXGT-UHFFFAOYSA-N
XLogP3.27
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-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

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine (CID 62202397) is N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine is CCNc1cc(C)nc(-c2ccc3c(c2)CCCN3C)n1.
What is the InChIKey of N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine?
The InChIKey is XAFYOXRGUQKXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-4-18-16-10-12(2)19-17(20-16)14-7-8-15-13(11-14)6-5-9-21(15)3/h7-8,10-11H,4-6,9H2,1-3H3,(H,18,19,20).
What are the key properties of N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine?
N-ethyl-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 3.27, 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-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrimidin-4-amine is sourced from PubChem (CID 62202397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).