3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide

C20H19N5O3 — CID 171566281

IUPAC3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide
SMILESCOCCOc1cc(C(=O)Nc2ccc3[nH]ncc3c2)cc(-n2ccnc2)c1
InChIInChI=1S/C20H19N5O3/c1-27-6-7-28-18-10-14(9-17(11-18)25-5-4-21-13-25)20(26)23-16-2-3-19-15(8-16)12-22-24-19/h2-5,8-13H,6-7H2,1H3,(H,22,24)(H,23,26)
InChIKeyAVFIIEOBKHCGHL-UHFFFAOYSA-N
MW377.40 g/mol
LogP3.03
Rot. Bonds7

About 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide

3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide (PubChem CID 171566281) has the molecular formula C20H19N5O3 and a molecular weight of 377.40 g/mol. Its IUPAC name is 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide.

Molecular Properties

Compound Name3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide
PubChem CID171566281
Molecular FormulaC20H19N5O3
Molecular Weight377.40 g/mol
Exact Mass377.15
IUPAC Name3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide
SMILESCOCCOc1cc(C(=O)Nc2ccc3[nH]ncc3c2)cc(-n2ccnc2)c1
InChIInChI=1S/C20H19N5O3/c1-27-6-7-28-18-10-14(9-17(11-18)25-5-4-21-13-25)20(26)23-16-2-3-19-15(8-16)12-22-24-19/h2-5,8-13H,6-7H2,1H3,(H,22,24)(H,23,26)
InChIKeyAVFIIEOBKHCGHL-UHFFFAOYSA-N
XLogP3.03
TPSA94.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.40
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-(1H-indazol-5-yl)-4-methylbenzamide
CID 17163732
N-(1H-indazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110475136
N-naphthalen-2-yl-1H-indazole-5-carboxamide
CID 69422881
N-(1H-indazol-5-yl)-2H-benzotriazole-5-carboxamide
CID 110468858
5,6-dichloro-N-(1H-indazol-5-yl)pyridine-3-carboxamide
CID 60712400
N-(1H-indazol-5-yl)-2,4,5-trimethoxybenzamide
CID 6468296
5-ethyl-N-(1H-indazol-5-yl)thiophene-3-carboxamide
CID 6467092
6-imidazol-1-yl-4-(2-methoxyethoxy)-N-[2-(trifluoromethyl)-4-pyridinyl]pyridine-2-carboxamide
CID 166481283
N-(1H-indazol-5-yl)-3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]benzamide
CID 55774547
4-imidazol-1-yl-N-(6-methoxy-3-pyridinyl)benzamide
CID 31532934
3-[5-(hydroxymethyl)imidazol-1-yl]-5-(2-methoxyethoxy)-N-[2-(trifluoromethyl)-4-pyridinyl]benzamide
CID 171566301
(E)-N'-(1H-indazol-5-yl)-N-[[1-(4-methoxyphenyl)pyrazol-3-yl]methyl]but-2-enediamide
CID 75387960

Frequently Asked Questions

What is the IUPAC name of 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide?
The IUPAC name of 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide (CID 171566281) is 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide.
What is the SMILES notation for 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide?
The canonical SMILES for 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide is COCCOc1cc(C(=O)Nc2ccc3[nH]ncc3c2)cc(-n2ccnc2)c1.
What is the InChIKey of 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide?
The InChIKey is AVFIIEOBKHCGHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O3/c1-27-6-7-28-18-10-14(9-17(11-18)25-5-4-21-13-25)20(26)23-16-2-3-19-15(8-16)12-22-24-19/h2-5,8-13H,6-7H2,1H3,(H,22,24)(H,23,26).
What are the key properties of 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide?
3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide has a molecular weight of 377.40 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazol-1-yl-N-(1H-indazol-5-yl)-5-(2-methoxyethoxy)benzamide is sourced from PubChem (CID 171566281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).