3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide

C20H17N3O3 — CID 135617763

IUPAC3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide
SMILESCOc1c(C(=O)NC2CC2)ccc2n[nH]c(-c3cc4ccccc4o3)c12
InChIInChI=1S/C20H17N3O3/c1-25-19-13(20(24)21-12-6-7-12)8-9-14-17(19)18(23-22-14)16-10-11-4-2-3-5-15(11)26-16/h2-5,8-10,12H,6-7H2,1H3,(H,21,24)(H,22,23)
InChIKeyPRVFAEVDFCRHOU-UHFFFAOYSA-N
MW347.37 g/mol
LogP3.88
Rot. Bonds4

About 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide

3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide (PubChem CID 135617763) has the molecular formula C20H17N3O3 and a molecular weight of 347.37 g/mol. Its IUPAC name is 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide
PubChem CID135617763
Molecular FormulaC20H17N3O3
Molecular Weight347.37 g/mol
Exact Mass347.13
IUPAC Name3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide
SMILESCOc1c(C(=O)NC2CC2)ccc2n[nH]c(-c3cc4ccccc4o3)c12
InChIInChI=1S/C20H17N3O3/c1-25-19-13(20(24)21-12-6-7-12)8-9-14-17(19)18(23-22-14)16-10-11-4-2-3-5-15(11)26-16/h2-5,8-10,12H,6-7H2,1H3,(H,21,24)(H,22,23)
InChIKeyPRVFAEVDFCRHOU-UHFFFAOYSA-N
XLogP3.88
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-1-oxopropan-2-yl)-3-(1-benzofuran-2-yl)-4-methoxy-2H-indazole-5-carboxamide
CID 135617758
3-(1-benzofuran-2-yl)-N-(1-hydroxy-3-methylbutan-2-yl)-4-methoxy-2H-indazole-5-carboxamide
CID 135617759
3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide;3-(1-benzofuran-2-yl)-N-(cyclopropylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-(1-benzofuran-2-yl)-N-(2-ethoxyethyl)-4-methoxy-2H-indazole-5-carboxamide;3-(1-benzofuran-2-yl)-N-(furan-2-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-(1-benzofuran-2-yl)-4-methoxy-N-[(3-methoxyphenyl)methyl]-2H-indazole-5-carboxamide;3-(1-benzofuran-2-yl)-4-methoxy-N-[(5-methylfuran-2-yl)methyl]-2H-indazole-5-carboxamide
CID 159225184
N-cyclopropyl-4-methoxy-3-(2-phenylethenyl)-2H-indazole-5-carboxamide
CID 136648690
N-(cyclopropylmethyl)-4-methoxy-3-naphthalen-2-yl-2H-indazole-5-carboxamide
CID 135617793
N-cyclopropyl-3-[(E)-2-(2-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide
CID 135987934
N-cyclopropyl-4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide
CID 173122824
2-oxo-N-piperidin-4-ylchromene-3-carboxamide
CID 43345783
3-(1-benzofuran-2-yl)-N-(2-ethoxyethyl)-4-methoxy-1H-indazole-5-carboxamide
CID 23589731
N-(4-aminocyclohexyl)-2-oxochromene-3-carboxamide
CID 79112826
5-(1-benzofuran-2-yl)-N-(1-oxaspiro[5.5]undecan-4-yl)-1H-pyrazole-4-carboxamide
CID 127984240
N-cyclopropyl-4-methoxynaphthalene-1-carboxamide
CID 27537333

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide?
The IUPAC name of 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide (CID 135617763) is 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide.
What is the SMILES notation for 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide?
The canonical SMILES for 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide is COc1c(C(=O)NC2CC2)ccc2n[nH]c(-c3cc4ccccc4o3)c12.
What is the InChIKey of 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide?
The InChIKey is PRVFAEVDFCRHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3/c1-25-19-13(20(24)21-12-6-7-12)8-9-14-17(19)18(23-22-14)16-10-11-4-2-3-5-15(11)26-16/h2-5,8-10,12H,6-7H2,1H3,(H,21,24)(H,22,23).
What are the key properties of 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide?
3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide has a molecular weight of 347.37 g/mol, XLogP of 3.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzofuran-2-yl)-N-cyclopropyl-4-methoxy-2H-indazole-5-carboxamide is sourced from PubChem (CID 135617763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).