4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine

C16H15N3O3 — CID 75359770

IUPAC4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine
SMILESCOc1ccc(OC)c(-c2cc(-c3ccco3)nc(N)n2)c1
InChIInChI=1S/C16H15N3O3/c1-20-10-5-6-14(21-2)11(8-10)12-9-13(19-16(17)18-12)15-4-3-7-22-15/h3-9H,1-2H3,(H2,17,18,19)
InChIKeyXSWYDQWXWNYEFB-UHFFFAOYSA-N
MW297.31 g/mol
LogP3.00
Rot. Bonds4

About 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine

4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine (PubChem CID 75359770) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine
PubChem CID75359770
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine
SMILESCOc1ccc(OC)c(-c2cc(-c3ccco3)nc(N)n2)c1
InChIInChI=1S/C16H15N3O3/c1-20-10-5-6-14(21-2)11(8-10)12-9-13(19-16(17)18-12)15-4-3-7-22-15/h3-9H,1-2H3,(H2,17,18,19)
InChIKeyXSWYDQWXWNYEFB-UHFFFAOYSA-N
XLogP3.00
TPSA83.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-4-(furan-2-yl)-5H-indeno[1,2-d]pyrimidin-5-one
CID 10445452
2-Amino-4-furan-2-yl-6-phenyl-pyrimidine-5-carbonitrile
CID 9813876
5-[2-amino-4-(2-furyl)pyrimidin-5-yl]-1-methylpyridin-2(1H)-one
CID 9814006
2-amino-6-(furan-2-yl)-N-(3-methylbenzyl)pyrimidine-4-carboxamide
CID 11162618
2-amino-6-(furan-2-yl)-N-(3-methoxybenzyl)pyrimidine-4-carboxamide
CID 11381738
2-amino-6-(furan-2-yl)-N-(2-methylbenzyl)pyrimidine-4-carboxamide
CID 11392671
2-amino-6-(furan-2-yl)-N-(2-methoxybenzyl)pyrimidine-4-carboxamide
CID 11393155
2-amino-N-(2-fluorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 11483771
5-{[4''-(2-furyl)-4,5''-bipyrimidin-2''-yl]amino}pyridin-2(1H)-one
CID 11544506
N-(3,5-dimethylphenyl)-4-(furan-2-yl)pyrimidin-2-amine
CID 14347058
7-(2,5-Dimethoxy-phenyl)-2-furan-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-ylamine
CID 23570284
2-amino-N-(4-fluorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 45267125

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine?
The IUPAC name of 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine (CID 75359770) is 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine is COc1ccc(OC)c(-c2cc(-c3ccco3)nc(N)n2)c1.
What is the InChIKey of 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine?
The InChIKey is XSWYDQWXWNYEFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-20-10-5-6-14(21-2)11(8-10)12-9-13(19-16(17)18-12)15-4-3-7-22-15/h3-9H,1-2H3,(H2,17,18,19).
What are the key properties of 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine?
4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine has a molecular weight of 297.31 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 75359770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).