N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide

C21H21N3O3 — CID 173122824

IUPACN-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide
SMILESCOc1ccc(C=Cc2[nH]nc3ccc(C(=O)NC4CC4)c(OC)c23)cc1
InChIInChI=1S/C21H21N3O3/c1-26-15-8-3-13(4-9-15)5-11-17-19-18(24-23-17)12-10-16(20(19)27-2)21(25)22-14-6-7-14/h3-5,8-12,14H,6-7H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyCJEMLVBTYBERTD-UHFFFAOYSA-N
MW363.42 g/mol
LogP3.64
Rot. Bonds6

About N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide

N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide (PubChem CID 173122824) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide
PubChem CID173122824
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC NameN-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide
SMILESCOc1ccc(C=Cc2[nH]nc3ccc(C(=O)NC4CC4)c(OC)c23)cc1
InChIInChI=1S/C21H21N3O3/c1-26-15-8-3-13(4-9-15)5-11-17-19-18(24-23-17)12-10-16(20(19)27-2)21(25)22-14-6-7-14/h3-5,8-12,14H,6-7H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyCJEMLVBTYBERTD-UHFFFAOYSA-N
XLogP3.64
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-4-methoxy-3-(2-phenylethenyl)-2H-indazole-5-carboxamide
CID 136648690
N-cyclopropyl-3-[(E)-2-(2-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide
CID 135987934
3-[2-(4-fluorophenyl)ethenyl]-N-[(1R,2R)-2-hydroxycyclohexyl]-4-methoxy-2H-indazole-5-carboxamide
CID 136651581
N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-(2-hydroxyethoxy)-2H-indazole-5-carboxamide
CID 136648325
N-[2-(butylamino)-2-oxoethyl]-3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide
CID 173122785
3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide
CID 135617763
3-[2-(4-fluorophenyl)ethenyl]-4-methoxy-N-piperidin-4-yl-1H-indazole-5-carboxamide
CID 72628015
3-[(E)-2-(4-aminophenyl)ethenyl]-N-[(1S)-2-hydroxy-1-phenylethyl]-4-methoxy-2H-indazole-5-carboxamide
CID 135987956
methyl 3-[2-(6-acetyl-3-pyridinyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylate
CID 173122685
N-cyclopropyl-4-methoxy-3-[(E)-2-pyridin-3-ylethenyl]-2H-indazole-5-carboxamide;N-cyclopropyl-4-methoxy-3-[(E)-2-thiophen-2-ylethenyl]-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-pyridin-3-ylethenyl]-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-thiophen-2-ylethenyl]-2H-indazole-5-carbonitrile;4-methoxy-3-[(E)-2-thiophen-2-ylethenyl]-2H-indazole-5-carboxylic acid
CID 160939870
N-cyclopropyl-3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-1H-indazole-5-carboxamide
CID 68933586
(E)-N-cyclopropyl-3-(4-methoxyphenyl)prop-2-enamide
CID 874267

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide (CID 173122824) is N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide is COc1ccc(C=Cc2[nH]nc3ccc(C(=O)NC4CC4)c(OC)c23)cc1.
What is the InChIKey of N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide?
The InChIKey is CJEMLVBTYBERTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c1-26-15-8-3-13(4-9-15)5-11-17-19-18(24-23-17)12-10-16(20(19)27-2)21(25)22-14-6-7-14/h3-5,8-12,14H,6-7H2,1-2H3,(H,22,25)(H,23,24).
What are the key properties of N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide?
N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 3.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide is sourced from PubChem (CID 173122824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).