N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide

C21H18N4O3 — CID 72564514

IUPACN-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide
SMILESCOc1c(C(=O)NCc2ccco2)ccc2[nH]nc(C=Cc3ccncc3)c12
InChIInChI=1S/C21H18N4O3/c1-27-20-16(21(26)23-13-15-3-2-12-28-15)5-7-18-19(20)17(24-25-18)6-4-14-8-10-22-11-9-14/h2-12H,13H2,1H3,(H,23,26)(H,24,25)
InChIKeyHUAQWCVNNPMNJE-UHFFFAOYSA-N
MW374.40 g/mol
LogP3.66
Rot. Bonds6

About N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide

N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide (PubChem CID 72564514) has the molecular formula C21H18N4O3 and a molecular weight of 374.40 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide
PubChem CID72564514
Molecular FormulaC21H18N4O3
Molecular Weight374.40 g/mol
Exact Mass374.14
IUPAC NameN-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide
SMILESCOc1c(C(=O)NCc2ccco2)ccc2[nH]nc(C=Cc3ccncc3)c12
InChIInChI=1S/C21H18N4O3/c1-27-20-16(21(26)23-13-15-3-2-12-28-15)5-7-18-19(20)17(24-25-18)6-4-14-8-10-22-11-9-14/h2-12H,13H2,1H3,(H,23,26)(H,24,25)
InChIKeyHUAQWCVNNPMNJE-UHFFFAOYSA-N
XLogP3.66
TPSA93.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2s)-1-{[6-Furan-3-Yl-5-(3-Methyl-2h-Indazol-5-Yl)pyridin-3-Yl]oxy}-3-(1h-Indol-3-Yl)propan-2-Amine
CID 46225540
(2S)-1-(1H-indol-3-yl)-3-(5-(3-methyl-1H-indazol-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propan-2-amine
CID 46190874
3-[(2S)-2-amino-3-phenylpropoxy]-5-[3-(furan-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridine
CID 23647441
(S)-1-(5-fluoro-1H-indol-3-yl)-3-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)propan-2-amine
CID 46190875
(S)-1-(6-fluoro-1H-indol-3-yl)-3-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)propan-2-amine
CID 46226075
(S)-1-(7-fluoro-1H-indol-3-yl)-3-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)propan-2-amine
CID 46226076
1'-(7-methyl-1H-indazole-5-carbonyl)-6-(1-methylpyrazol-4-yl)spiro[3H-pyrano[2,3-c]pyridine-2,4'-piperidine]-4-one
CID 46884847
(S)-1-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)-3-phenylpropan-2-amine
CID 11495551
(S)-1-(6-(furan-2-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)-3-phenylpropan-2-amine
CID 11633229
N-[3-methoxy-4-(5-oxazolyl)phenyl]-1H-indazole-3-carboxamide
CID 44329815
4-(4-Isopropoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-1-isopropyl-N-(oxetan-3-yl)-1H-pyrrole-2-carboxaMide
CID 56941655
2-Indazol-1-yl-1-[4-[3-methoxy-4-(2-methyl-1,3-oxazol-5-yl)phenyl]piperazin-1-yl]ethanone
CID 70802787

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide (CID 72564514) is N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide is COc1c(C(=O)NCc2ccco2)ccc2[nH]nc(C=Cc3ccncc3)c12.
What is the InChIKey of N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide?
The InChIKey is HUAQWCVNNPMNJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O3/c1-27-20-16(21(26)23-13-15-3-2-12-28-15)5-7-18-19(20)17(24-25-18)6-4-14-8-10-22-11-9-14/h2-12H,13H2,1H3,(H,23,26)(H,24,25).
What are the key properties of N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide?
N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-methoxy-3-(2-pyridin-4-ylethenyl)-1H-indazole-5-carboxamide is sourced from PubChem (CID 72564514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).