N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide

C22H15N5O2 — CID 71602062

IUPACN-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide
SMILESO=C(Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12)c1ccco1
InChIInChI=1S/C22H15N5O2/c28-22(18-12-7-13-29-18)25-21-19-17(14-27(26-19)16-10-5-2-6-11-16)23-20(24-21)15-8-3-1-4-9-15/h1-14H,(H,23,24,25,28)
InChIKeyXMKAPKONJGDUHQ-UHFFFAOYSA-N
MW381.40 g/mol
LogP4.33
Rot. Bonds4

About N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide

N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide (PubChem CID 71602062) has the molecular formula C22H15N5O2 and a molecular weight of 381.40 g/mol. Its IUPAC name is N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide
PubChem CID71602062
Molecular FormulaC22H15N5O2
Molecular Weight381.40 g/mol
Exact Mass381.12
IUPAC NameN-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide
SMILESO=C(Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12)c1ccco1
InChIInChI=1S/C22H15N5O2/c28-22(18-12-7-13-29-18)25-21-19-17(14-27(26-19)16-10-5-2-6-11-16)23-20(24-21)15-8-3-1-4-9-15/h1-14H,(H,23,24,25,28)
InChIKeyXMKAPKONJGDUHQ-UHFFFAOYSA-N
XLogP4.33
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.40
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[4-(Furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-yl]-3-phenylurea
CID 9929470
8-(Furan-2-yl)-3-[2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]ethyl]-[1,2,4]triazolo[5,1-f]purin-5-amine
CID 10203891
1-(2-(furan-2-yl)-8-phenethyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-3-(4-methoxyphenyl)urea
CID 10791347
1-(2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-3-p-tolylurea
CID 10905184
1-[4-(Furan-2-yl)-11-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-yl]-3-(4-methylphenyl)urea
CID 10938608
3-(2-fluorophenyl)-7-(furan-2-yl)-2-((2-methyl-2H-1,2,4-triazol-3-yl)methoxy)pyrazolo[1,5-d][1,2,4]triazine
CID 18406903
4-(Furan-2-yl)-10-[2-(4-pyrazin-2-ylphenyl)ethyl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
CID 21363905
N-(6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl)-2-(4-((dimethylamino)methyl)phenoxy)acetamide
CID 24739309
3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-6-yl)-N,N-diethyl-benzamide
CID 44403132
5-Amino-8-(furan-2-yl)-1-methyl-3-[2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]ethyl]-[1,2,4]triazolo[5,1-f]purin-2-one
CID 56943869
N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
CID 938552
N-(2-Furylmethyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 220776

Frequently Asked Questions

What is the IUPAC name of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
The IUPAC name of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide (CID 71602062) is N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide.
What is the SMILES notation for N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
The canonical SMILES for N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide is O=C(Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12)c1ccco1.
What is the InChIKey of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
The InChIKey is XMKAPKONJGDUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N5O2/c28-22(18-12-7-13-29-18)25-21-19-17(14-27(26-19)16-10-5-2-6-11-16)23-20(24-21)15-8-3-1-4-9-15/h1-14H,(H,23,24,25,28).
What are the key properties of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide has a molecular weight of 381.40 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide is sourced from PubChem (CID 71602062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).