6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine

C16H16N4 — CID 78958804

IUPAC6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine
SMILESCCc1cc(NCc2cccc3cccnc23)ncn1
InChIInChI=1S/C16H16N4/c1-2-14-9-15(20-11-19-14)18-10-13-6-3-5-12-7-4-8-17-16(12)13/h3-9,11H,2,10H2,1H3,(H,18,19,20)
InChIKeyHIXNJLKGFKTIDO-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.20
Rot. Bonds4

About 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine

6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine (PubChem CID 78958804) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine
PubChem CID78958804
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine
SMILESCCc1cc(NCc2cccc3cccnc23)ncn1
InChIInChI=1S/C16H16N4/c1-2-14-9-15(20-11-19-14)18-10-13-6-3-5-12-7-4-8-17-16(12)13/h3-9,11H,2,10H2,1H3,(H,18,19,20)
InChIKeyHIXNJLKGFKTIDO-UHFFFAOYSA-N
XLogP3.20
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-ethyl-N-(quinolin-8-ylmethyl)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

2-methyl-N-(quinolin-8-ylmethyl)propan-2-amine
CID 28608485
4-methyl-2-N-(quinolin-8-ylmethyl)pyridine-2,5-diamine
CID 81426632
6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
CID 55057435
2-N-methyl-4-N-(quinolin-8-ylmethyl)pyrimidine-2,4-diamine
CID 81424090
N-(quinolin-8-ylmethyl)aniline
CID 28610045
6-N,5-dimethyl-4-N-(quinolin-8-ylmethyl)pyrimidine-4,6-diamine
CID 81435677
4-methyl-N-(quinolin-8-ylmethyl)aniline
CID 28619601
2-hydrazinyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine
CID 81423611
3-N-(quinolin-8-ylmethyl)benzene-1,3-diamine
CID 81428850
2-ethoxy-N-(quinolin-8-ylmethyl)aniline
CID 28612848
5-bromo-N-(quinolin-8-ylmethyl)pyrimidin-2-amine
CID 78953418
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine (CID 78958804) is 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine is CCc1cc(NCc2cccc3cccnc23)ncn1.
What is the InChIKey of 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine?
The InChIKey is HIXNJLKGFKTIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-2-14-9-15(20-11-19-14)18-10-13-6-3-5-12-7-4-8-17-16(12)13/h3-9,11H,2,10H2,1H3,(H,18,19,20).
What are the key properties of 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine?
6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine has a molecular weight of 264.33 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 78958804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).