N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide

C23H24N4O3 — CID 53196029

IUPACN-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
SMILESCCn1c(-c2cc(NC(=O)c3cc(OC)cc(OC)c3)n[nH]2)c(C)c2ccccc21
InChIInChI=1S/C23H24N4O3/c1-5-27-20-9-7-6-8-18(20)14(2)22(27)19-13-21(26-25-19)24-23(28)15-10-16(29-3)12-17(11-15)30-4/h6-13H,5H2,1-4H3,(H2,24,25,26,28)
InChIKeyINJWJHZYWFPZBV-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.63
Rot. Bonds6

About N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide

N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide (PubChem CID 53196029) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
PubChem CID53196029
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC NameN-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
SMILESCCn1c(-c2cc(NC(=O)c3cc(OC)cc(OC)c3)n[nH]2)c(C)c2ccccc21
InChIInChI=1S/C23H24N4O3/c1-5-27-20-9-7-6-8-18(20)14(2)22(27)19-13-21(26-25-19)24-23(28)15-10-16(29-3)12-17(11-15)30-4/h6-13H,5H2,1-4H3,(H2,24,25,26,28)
InChIKeyINJWJHZYWFPZBV-UHFFFAOYSA-N
XLogP4.63
TPSA81.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]benzamide
CID 53196047
3,4-diethoxy-N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]benzamide
CID 53196058
N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-2-methylbenzamide
CID 53196042
N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-2-fluorobenzamide
CID 53196031
N-[5-(1-ethyl-5-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
CID 53195961
N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-2-thiophen-2-ylacetamide
CID 53196056
N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide
CID 53196197
3,5-dimethoxy-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide
CID 110866777
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]acetamide
CID 53196135
N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]pyridine-4-carboxamide
CID 53196167
5-bromo-N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
CID 53196151
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-(3-methoxyphenyl)acetamide
CID 53196096

Frequently Asked Questions

What is the IUPAC name of N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide (CID 53196029) is N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide is CCn1c(-c2cc(NC(=O)c3cc(OC)cc(OC)c3)n[nH]2)c(C)c2ccccc21.
What is the InChIKey of N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide?
The InChIKey is INJWJHZYWFPZBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O3/c1-5-27-20-9-7-6-8-18(20)14(2)22(27)19-13-21(26-25-19)24-23(28)15-10-16(29-3)12-17(11-15)30-4/h6-13H,5H2,1-4H3,(H2,24,25,26,28).
What are the key properties of N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide?
N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide has a molecular weight of 404.47 g/mol, XLogP of 4.63, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 53196029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).