(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine

C19H20N4O — CID 8892568

IUPAC(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine
SMILESCC(C)n1ncc2c1N=C(c1ccco1)N(C)[C@@H]2c1ccccc1
InChIInChI=1S/C19H20N4O/c1-13(2)23-18-15(12-20-23)17(14-8-5-4-6-9-14)22(3)19(21-18)16-10-7-11-24-16/h4-13,17H,1-3H3/t17-/m1/s1
InChIKeyCSMCQAOJDCFAPC-QGZVFWFLSA-N
MW320.40 g/mol
LogP4.17
Rot. Bonds3

About (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine

(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine (PubChem CID 8892568) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine.

Molecular Properties

Compound Name(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine
PubChem CID8892568
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine
SMILESCC(C)n1ncc2c1N=C(c1ccco1)N(C)[C@@H]2c1ccccc1
InChIInChI=1S/C19H20N4O/c1-13(2)23-18-15(12-20-23)17(14-8-5-4-6-9-14)22(3)19(21-18)16-10-7-11-24-16/h4-13,17H,1-3H3/t17-/m1/s1
InChIKeyCSMCQAOJDCFAPC-QGZVFWFLSA-N
XLogP4.17
TPSA46.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
The IUPAC name of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine (CID 8892568) is (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine.
What is the SMILES notation for (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
The canonical SMILES for (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine is CC(C)n1ncc2c1N=C(c1ccco1)N(C)[C@@H]2c1ccccc1.
What is the InChIKey of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
The InChIKey is CSMCQAOJDCFAPC-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13(2)23-18-15(12-20-23)17(14-8-5-4-6-9-14)22(3)19(21-18)16-10-7-11-24-16/h4-13,17H,1-3H3/t17-/m1/s1.
What are the key properties of (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine?
(4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine has a molecular weight of 320.40 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-(furan-2-yl)-5-methyl-4-phenyl-1-propan-2-yl-4H-pyrazolo[5,4-d]pyrimidine is sourced from PubChem (CID 8892568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).