6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine

C16H19N3O — CID 114747241

IUPAC6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-c2cccc3c2OCC3)n1
InChIInChI=1S/C16H19N3O/c1-3-5-13-18-14(10(2)16(17)19-13)12-7-4-6-11-8-9-20-15(11)12/h4,6-7H,3,5,8-9H2,1-2H3,(H2,17,18,19)
InChIKeyWGDDQYKPJHJZQB-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.92
Rot. Bonds3

About 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine

6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine (PubChem CID 114747241) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine
PubChem CID114747241
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-c2cccc3c2OCC3)n1
InChIInChI=1S/C16H19N3O/c1-3-5-13-18-14(10(2)16(17)19-13)12-7-4-6-11-8-9-20-15(11)12/h4,6-7H,3,5,8-9H2,1-2H3,(H2,17,18,19)
InChIKeyWGDDQYKPJHJZQB-UHFFFAOYSA-N
XLogP2.92
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-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

6-(2,3-dihydro-1-benzofuran-7-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
CID 114747223
5-methyl-2-propyl-6-quinolin-8-ylpyrimidin-4-amine
CID 81227897
5-methyl-2-propyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 80978112
4-chloro-6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propan-2-ylpyrimidine
CID 114747119
6-(3,4-dihydro-2H-chromen-8-yl)-N-ethyl-2,5-dimethylpyrimidin-4-amine
CID 114747414
6-(2,3-dihydro-1-benzofuran-7-yl)-5-propan-2-ylpyrimidin-4-amine
CID 114747278
6-(4-methoxy-2-methylphenyl)-5-methyl-2-propylpyrimidin-4-amine
CID 80976055
2-(2,3-dihydro-1-benzofuran-7-yl)pyridin-3-amine
CID 114746394
5-methyl-2-propyl-6-(1H-pyrrol-2-yl)pyrimidin-4-amine
CID 103341932
5-methyl-6-(7-methyl-1-benzofuran-2-yl)-2-propylpyrimidin-4-amine
CID 114734621
6-(4-fluorophenyl)-5-methyl-2-propylpyrimidin-4-amine
CID 80975052
7-(4-methylphenyl)-2,3-dihydro-1-benzofuran
CID 23543625

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine?
The IUPAC name of 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine (CID 114747241) is 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine is CCCc1nc(N)c(C)c(-c2cccc3c2OCC3)n1.
What is the InChIKey of 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine?
The InChIKey is WGDDQYKPJHJZQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-5-13-18-14(10(2)16(17)19-13)12-7-4-6-11-8-9-20-15(11)12/h4,6-7H,3,5,8-9H2,1-2H3,(H2,17,18,19).
What are the key properties of 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine?
6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine has a molecular weight of 269.35 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dihydro-1-benzofuran-7-yl)-5-methyl-2-propylpyrimidin-4-amine is sourced from PubChem (CID 114747241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).