5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

C18H16N4O2 — CID 11381622

IUPAC5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCOc1ccc(CNc2cc(-c3ccoc3)nc3ccnn23)cc1
InChIInChI=1S/C18H16N4O2/c1-23-15-4-2-13(3-5-15)11-19-18-10-16(14-7-9-24-12-14)21-17-6-8-20-22(17)18/h2-10,12,19H,11H2,1H3
InChIKeyRWWAIHDACSJZBE-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.61
Rot. Bonds5

About 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 11381622) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID11381622
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC Name5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCOc1ccc(CNc2cc(-c3ccoc3)nc3ccnn23)cc1
InChIInChI=1S/C18H16N4O2/c1-23-15-4-2-13(3-5-15)11-19-18-10-16(14-7-9-24-12-14)21-17-6-8-20-22(17)18/h2-10,12,19H,11H2,1H3
InChIKeyRWWAIHDACSJZBE-UHFFFAOYSA-N
XLogP3.61
TPSA64.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 11381622) is 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine is COc1ccc(CNc2cc(-c3ccoc3)nc3ccnn23)cc1.
What is the InChIKey of 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is RWWAIHDACSJZBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c1-23-15-4-2-13(3-5-15)11-19-18-10-16(14-7-9-24-12-14)21-17-6-8-20-22(17)18/h2-10,12,19H,11H2,1H3.
What are the key properties of 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 320.35 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-3-yl)-N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 11381622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).