N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide

C23H24N4O2 — CID 53196197

IUPACN-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide
SMILESCCn1c(-c2cc(NC(=O)c3cc(C)cc(C)c3)n[nH]2)cc2ccc(OC)cc21
InChIInChI=1S/C23H24N4O2/c1-5-27-20-12-18(29-4)7-6-16(20)11-21(27)19-13-22(26-25-19)24-23(28)17-9-14(2)8-15(3)10-17/h6-13H,5H2,1-4H3,(H2,24,25,26,28)
InChIKeyCJJUDPLJFACCTB-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.93
Rot. Bonds5

About N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide

N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide (PubChem CID 53196197) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide
PubChem CID53196197
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide
SMILESCCn1c(-c2cc(NC(=O)c3cc(C)cc(C)c3)n[nH]2)cc2ccc(OC)cc21
InChIInChI=1S/C23H24N4O2/c1-5-27-20-12-18(29-4)7-6-16(20)11-21(27)19-13-22(26-25-19)24-23(28)17-9-14(2)8-15(3)10-17/h6-13H,5H2,1-4H3,(H2,24,25,26,28)
InChIKeyCJJUDPLJFACCTB-UHFFFAOYSA-N
XLogP4.93
TPSA71.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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-5-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
CID 53195961
N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-(3-methoxyphenyl)acetamide
CID 53196168
N-[5-(1-ethyl-5-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxypropanamide
CID 53196011
N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
CID 53196029
N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide
CID 53195937
N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]furan-2-carboxamide
CID 53195881
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-(3-methoxyphenyl)acetamide
CID 53196096
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]acetamide
CID 53196135
N-(2,5-dimethoxyphenyl)-3,5-dimethylbenzamide
CID 918722
5-bromo-N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]furan-2-carboxamide
CID 53196082

Frequently Asked Questions

What is the IUPAC name of N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide?
The IUPAC name of N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide (CID 53196197) is N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide is CCn1c(-c2cc(NC(=O)c3cc(C)cc(C)c3)n[nH]2)cc2ccc(OC)cc21.
What is the InChIKey of N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide?
The InChIKey is CJJUDPLJFACCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-5-27-20-12-18(29-4)7-6-16(20)11-21(27)19-13-22(26-25-19)24-23(28)17-9-14(2)8-15(3)10-17/h6-13H,5H2,1-4H3,(H2,24,25,26,28).
What are the key properties of N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide?
N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide has a molecular weight of 388.47 g/mol, XLogP of 4.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethylbenzamide is sourced from PubChem (CID 53196197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).