5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide

C20H25N3O4 — CID 74459525

IUPAC5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide
SMILESCOc1cc(NC(=O)C2CC(c3ccc(C)cc3)NN2)cc(OC)c1OC
InChIInChI=1S/C20H25N3O4/c1-12-5-7-13(8-6-12)15-11-16(23-22-15)20(24)21-14-9-17(25-2)19(27-4)18(10-14)26-3/h5-10,15-16,22-23H,11H2,1-4H3,(H,21,24)
InChIKeyAIEPAFMEOKSGPZ-UHFFFAOYSA-N
MW371.44 g/mol
LogP2.57
Rot. Bonds6

About 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide

5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide (PubChem CID 74459525) has the molecular formula C20H25N3O4 and a molecular weight of 371.44 g/mol. Its IUPAC name is 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide
PubChem CID74459525
Molecular FormulaC20H25N3O4
Molecular Weight371.44 g/mol
Exact Mass371.18
IUPAC Name5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide
SMILESCOc1cc(NC(=O)C2CC(c3ccc(C)cc3)NN2)cc(OC)c1OC
InChIInChI=1S/C20H25N3O4/c1-12-5-7-13(8-6-12)15-11-16(23-22-15)20(24)21-14-9-17(25-2)19(27-4)18(10-14)26-3/h5-10,15-16,22-23H,11H2,1-4H3,(H,21,24)
InChIKeyAIEPAFMEOKSGPZ-UHFFFAOYSA-N
XLogP2.57
TPSA80.85 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,5-dimethylphenyl)-5-(4-methylphenyl)pyrazolidine-3-carboxamide
CID 75605659
N-(4-chloro-2-methoxy-5-methylphenyl)-5-(4-methylphenyl)pyrazolidine-3-carboxamide
CID 75283567
methyl 4-[[5-(4-methylphenyl)pyrazolidine-3-carbonyl]amino]benzoate
CID 74486868
N-(3,4-dimethoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975396
N-(3-chloro-4-methoxyphenyl)-5-(4-chlorophenyl)pyrazolidine-3-carboxamide
CID 75085710
N-(3-chloro-4-methoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975433
N-(3-acetylphenyl)-5-(4-methoxyphenyl)pyrazolidine-3-carboxamide
CID 75234345
N-(2,4-dimethoxyphenyl)-5-phenylpyrazolidine-3-carboxamide
CID 74523011
5-oxo-N-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxamide
CID 110689736
5-[3-(ethylsulfamoyl)-4-methoxyphenyl]-N-(3-methylphenyl)pyrazolidine-3-carboxamide
CID 75543400
N-[4-(azepan-1-ylsulfonyl)phenyl]-5-(4-methylphenyl)pyrazolidine-3-carboxamide
CID 75605691
N-(5-chloro-2,4-dimethoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975401

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide?
The IUPAC name of 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide (CID 74459525) is 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide?
The canonical SMILES for 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide is COc1cc(NC(=O)C2CC(c3ccc(C)cc3)NN2)cc(OC)c1OC.
What is the InChIKey of 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide?
The InChIKey is AIEPAFMEOKSGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O4/c1-12-5-7-13(8-6-12)15-11-16(23-22-15)20(24)21-14-9-17(25-2)19(27-4)18(10-14)26-3/h5-10,15-16,22-23H,11H2,1-4H3,(H,21,24).
What are the key properties of 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide?
5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 2.57, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 74459525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).