3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide

C27H27FN4O4 — CID 72628040

IUPAC3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide
SMILESCOc1c(C(=O)NCc2ccc(CN3CCOCC3)o2)ccc2[nH]nc(C=Cc3ccc(F)cc3)c12
InChIInChI=1S/C27H27FN4O4/c1-34-26-22(27(33)29-16-20-7-8-21(36-20)17-32-12-14-35-15-13-32)9-11-24-25(26)23(30-31-24)10-4-18-2-5-19(28)6-3-18/h2-11H,12-17H2,1H3,(H,29,33)(H,30,31)
InChIKeyXFGNGIGDNNXOPR-UHFFFAOYSA-N
MW490.54 g/mol
LogP4.24
Rot. Bonds8

About 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide

3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide (PubChem CID 72628040) has the molecular formula C27H27FN4O4 and a molecular weight of 490.54 g/mol. Its IUPAC name is 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide
PubChem CID72628040
Molecular FormulaC27H27FN4O4
Molecular Weight490.54 g/mol
Exact Mass490.20
IUPAC Name3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide
SMILESCOc1c(C(=O)NCc2ccc(CN3CCOCC3)o2)ccc2[nH]nc(C=Cc3ccc(F)cc3)c12
InChIInChI=1S/C27H27FN4O4/c1-34-26-22(27(33)29-16-20-7-8-21(36-20)17-32-12-14-35-15-13-32)9-11-24-25(26)23(30-31-24)10-4-18-2-5-19(28)6-3-18/h2-11H,12-17H2,1H3,(H,29,33)(H,30,31)
InChIKeyXFGNGIGDNNXOPR-UHFFFAOYSA-N
XLogP4.24
TPSA92.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.54
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-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

1-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-2-[(3-methyl-2H-indazol-4-yl)oxy]propan-1-one
CID 45487308
N-(cyclopropyl(phenyl)methyl)-3-(4-((1-formylpiperidin-4-yl)oxy)phenyl)-1H-indazole-5-carboxamide
CID 86711021
N-(cyclopropyl(phenyl)methyl)-3-(4-((1-methylpiperidin-4-yl)oxy)phenyl)-1H-indazole-5-carboxamide
CID 89509708
N-[cyclopropyl(phenyl)methyl]-3-[4-[1-[2-(dimethylamino)acetyl]piperidin-4-yl]oxyphenyl]-1H-indazole-5-carboxamide
CID 89509786
N-[cyclopropyl(phenyl)methyl]-3-[4-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]oxy]phenyl]-1H-indazole-5-carboxamide
CID 89971933
6-hydroxy-N-[(4-methoxyphenyl)methyl]-N-methyl-3-[(3-methylphenyl)methyl]-1H-indazole-5-carboxamide
CID 137630304
3-benzyl-N-[(4-ethoxyphenyl)methyl]-6-hydroxy-N-methyl-1H-indazole-5-carboxamide
CID 137630325
6-hydroxy-N-methyl-3-[(3-methylphenyl)methyl]-N-[4-(morpholin-4-ylmethyl)phenyl]-1H-indazole-5-carboxamide
CID 145734636
3-butyl-6-hydroxy-N-methyl-N-(4-morpholin-4-ylphenyl)-1H-indazole-5-carboxamide
CID 145963762
6-hydroxy-3-[(3-methoxyphenyl)methyl]-N-methyl-N-(4-morpholin-4-ylphenyl)-1H-indazole-5-carboxamide
CID 145970991
6-hydroxy-N-methyl-N-(4-morpholin-4-ylphenyl)-3-propyl-1H-indazole-5-carboxamide
CID 145973891
1'-(7-methyl-1H-indazole-5-carbonyl)-6-(1H-pyrazol-5-yl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 46884797

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide?
The IUPAC name of 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide (CID 72628040) is 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide?
The canonical SMILES for 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide is COc1c(C(=O)NCc2ccc(CN3CCOCC3)o2)ccc2[nH]nc(C=Cc3ccc(F)cc3)c12.
What is the InChIKey of 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide?
The InChIKey is XFGNGIGDNNXOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27FN4O4/c1-34-26-22(27(33)29-16-20-7-8-21(36-20)17-32-12-14-35-15-13-32)9-11-24-25(26)23(30-31-24)10-4-18-2-5-19(28)6-3-18/h2-11H,12-17H2,1H3,(H,29,33)(H,30,31).
What are the key properties of 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide?
3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide has a molecular weight of 490.54 g/mol, XLogP of 4.24, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]-1H-indazole-5-carboxamide is sourced from PubChem (CID 72628040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).