3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide

C24H23N3O2 — CID 165385027

IUPAC3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide
SMILESCCOc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1-c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-3-29-22-14-18(12-13-21(22)17-8-5-4-6-9-17)24(28)27(2)16-20-11-7-10-19-15-25-26-23(19)20/h4-15H,3,16H2,1-2H3,(H,25,26)
InChIKeySGLSVXHGYJMGDP-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.90
Rot. Bonds6

About 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide

3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide (PubChem CID 165385027) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide.

Molecular Properties

Compound Name3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide
PubChem CID165385027
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide
SMILESCCOc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1-c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-3-29-22-14-18(12-13-21(22)17-8-5-4-6-9-17)24(28)27(2)16-20-11-7-10-19-15-25-26-23(19)20/h4-15H,3,16H2,1-2H3,(H,25,26)
InChIKeySGLSVXHGYJMGDP-UHFFFAOYSA-N
XLogP4.90
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1'-(1h-Indazol-7-ylcarbonyl)-6-methylspiro[chromene-2,4'-piperidin]-4(3h)-one
CID 45100495
6,7-Dimethyl-1'-[(7-Methyl-1h-Indazol-5-Yl)carbonyl]spiro[chromene-2,4'-Piperidin]-4(3h)-One
CID 46884569
3-methoxy-N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-(1H-pyrazol-4-yl)benzamide
CID 90354217
N-[(1S)-2-amino-1-phenylethyl]-3-methoxy-4-(1H-pyrazol-4-yl)benzamide
CID 90385099
N-[(1R)-1-(3-methoxyphenyl)ethyl]-3-methyl-4-(1H-pyrazol-4-yl)benzamide
CID 118662999
2-fluoro-3-methoxy-N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-(1H-pyrazol-4-yl)benzamide
CID 118663021
3-ethoxy-N-(1H-indazol-5-yl)benzamide
CID 6468066
3-ethyl-N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-(1H-pyrazol-4-yl)benzamide
CID 162670833
1'-(1H-indazole-7-carbonyl)-6,7-dimethylspiro[chroman-2,4'-piperidin]-4-one
CID 24957986
N-{[cis-4-(2-Phenoxyethyl)cyclohexyl]methyl}-1H-indazole-5-carboxamide
CID 44442113
1'-(7-ethyl-1H-indazole-5-carbonyl)-6,7-dimethylspiro[3H-chromene-2,4'-piperidine]-4-one
CID 46884620
1''-(1H-indazole-7-carbonyl)-7-methylspiro[chroman-2,4''-piperidin]-4-one
CID 46885251

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide?
The IUPAC name of 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide (CID 165385027) is 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide.
What is the SMILES notation for 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide?
The canonical SMILES for 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide is CCOc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1-c1ccccc1.
What is the InChIKey of 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide?
The InChIKey is SGLSVXHGYJMGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-3-29-22-14-18(12-13-21(22)17-8-5-4-6-9-17)24(28)27(2)16-20-11-7-10-19-15-25-26-23(19)20/h4-15H,3,16H2,1-2H3,(H,25,26).
What are the key properties of 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide?
3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide has a molecular weight of 385.47 g/mol, XLogP of 4.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide is sourced from PubChem (CID 165385027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).