2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine

C15H18FN3 — CID 80936849

IUPAC2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(-c2ccccc2F)nc(CC)n1
InChIInChI=1S/C15H18FN3/c1-3-9-17-15-10-13(18-14(4-2)19-15)11-7-5-6-8-12(11)16/h5-8,10H,3-4,9H2,1-2H3,(H,17,18,19)
InChIKeyACWWNYMKURDNMI-UHFFFAOYSA-N
MW259.33 g/mol
LogP3.67
Rot. Bonds5

About 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine

2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine (PubChem CID 80936849) has the molecular formula C15H18FN3 and a molecular weight of 259.33 g/mol. Its IUPAC name is 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine
PubChem CID80936849
Molecular FormulaC15H18FN3
Molecular Weight259.33 g/mol
Exact Mass259.15
IUPAC Name2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(-c2ccccc2F)nc(CC)n1
InChIInChI=1S/C15H18FN3/c1-3-9-17-15-10-13(18-14(4-2)19-15)11-7-5-6-8-12(11)16/h5-8,10H,3-4,9H2,1-2H3,(H,17,18,19)
InChIKeyACWWNYMKURDNMI-UHFFFAOYSA-N
XLogP3.67
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-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-cyclopropyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine
CID 80952552
2-ethyl-6-(5-fluoro-2-methoxyphenyl)-N-propylpyrimidin-4-amine
CID 80939031
6-(2,5-difluorophenyl)-N,2-diethylpyrimidin-4-amine
CID 80936764
N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine
CID 80935861
2-ethyl-4-N-[(4-fluorophenyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80939677
2-[(2-fluorophenyl)methyl]-N,6-dipropylpyrimidin-4-amine
CID 63485042
2-ethyl-6-(2-fluorophenyl)-5-methyl-N-propylpyrimidin-4-amine
CID 80975172
6-chloro-2-ethyl-N-[2-(2-fluorophenyl)ethyl]pyrimidin-4-amine
CID 80936245
2-ethyl-6-(4-methoxy-2-methylphenyl)-N-propylpyrimidin-4-amine
CID 80939033
6-(2,4-difluorophenyl)-2-ethyl-N-methylpyrimidin-4-amine
CID 80935782
2-ethyl-6-(4-methoxyphenyl)-N-propylpyrimidin-4-amine
CID 80936844
2-ethyl-N-propyl-6-(3-propylphenyl)pyrimidin-4-amine
CID 116546086

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine (CID 80936849) is 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine is CCCNc1cc(-c2ccccc2F)nc(CC)n1.
What is the InChIKey of 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine?
The InChIKey is ACWWNYMKURDNMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3/c1-3-9-17-15-10-13(18-14(4-2)19-15)11-7-5-6-8-12(11)16/h5-8,10H,3-4,9H2,1-2H3,(H,17,18,19).
What are the key properties of 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine?
2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine has a molecular weight of 259.33 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80936849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).