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

C27H17N5O4 — CID 71600100

IUPACN-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide
SMILESO=C(c1ccco1)N(C(=O)c1ccco1)c1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12
InChIInChI=1S/C27H17N5O4/c33-26(21-13-7-15-35-21)32(27(34)22-14-8-16-36-22)25-23-20(17-31(30-23)19-11-5-2-6-12-19)28-24(29-25)18-9-3-1-4-10-18/h1-17H
InChIKeyATZGHDIPHMJNDA-UHFFFAOYSA-N
MW475.46 g/mol
LogP5.16
Rot. Bonds5

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

N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide (PubChem CID 71600100) has the molecular formula C27H17N5O4 and a molecular weight of 475.46 g/mol. Its IUPAC name is N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide
PubChem CID71600100
Molecular FormulaC27H17N5O4
Molecular Weight475.46 g/mol
Exact Mass475.13
IUPAC NameN-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide
SMILESO=C(c1ccco1)N(C(=O)c1ccco1)c1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12
InChIInChI=1S/C27H17N5O4/c33-26(21-13-7-15-35-21)32(27(34)22-14-8-16-36-22)25-23-20(17-31(30-23)19-11-5-2-6-12-19)28-24(29-25)18-9-3-1-4-10-18/h1-17H
InChIKeyATZGHDIPHMJNDA-UHFFFAOYSA-N
XLogP5.16
TPSA107.26 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.46
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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

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
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
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
[7-(Difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl][4-(furan-2-ylcarbonyl)piperazin-1-yl]methanone
CID 2169042
[3-(10-Morpholin-4-yl-1,6,11,13-tetrazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaen-12-yl)phenyl] furan-2-carboxylate
CID 57391047
Glpg-0259
CID 44462738
4-(8-((4-(4-(tert-Butyl)piperazin-1-yl)phenyl)amino)-[1,2,4]triazolo[1,5-a]pyrazin-5-yl)furan-2-carboxamide
CID 57589985
4-[2-[7-amino-4-(furan-2-yl)-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]ethyl]-N-(2-aminophenyl)benzamide
CID 166633598
N-(1-propyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-2-furamide
CID 944687

Frequently Asked Questions

What is the IUPAC name of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide?
The IUPAC name of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide (CID 71600100) is N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide.
What is the SMILES notation for N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide?
The canonical SMILES for N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide is O=C(c1ccco1)N(C(=O)c1ccco1)c1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12.
What is the InChIKey of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide?
The InChIKey is ATZGHDIPHMJNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17N5O4/c33-26(21-13-7-15-35-21)32(27(34)22-14-8-16-36-22)25-23-20(17-31(30-23)19-11-5-2-6-12-19)28-24(29-25)18-9-3-1-4-10-18/h1-17H.
What are the key properties of N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide?
N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide has a molecular weight of 475.46 g/mol, XLogP of 5.16, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-diphenylpyrazolo[4,3-d]pyrimidin-7-yl)-N-(furan-2-carbonyl)furan-2-carboxamide is sourced from PubChem (CID 71600100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).