N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide

C18H19Cl2N3O2 — CID 75254833

IUPACN-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
SMILESCCOc1ccc(C2CC(C(=O)Nc3cccc(Cl)c3Cl)NN2)cc1
InChIInChI=1S/C18H19Cl2N3O2/c1-2-25-12-8-6-11(7-9-12)15-10-16(23-22-15)18(24)21-14-5-3-4-13(19)17(14)20/h3-9,15-16,22-23H,2,10H2,1H3,(H,21,24)
InChIKeyNLBUKLLUWGJAQI-UHFFFAOYSA-N
MW380.28 g/mol
LogP3.94
Rot. Bonds5

About N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide

N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide (PubChem CID 75254833) has the molecular formula C18H19Cl2N3O2 and a molecular weight of 380.28 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
PubChem CID75254833
Molecular FormulaC18H19Cl2N3O2
Molecular Weight380.28 g/mol
Exact Mass379.09
IUPAC NameN-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
SMILESCCOc1ccc(C2CC(C(=O)Nc3cccc(Cl)c3Cl)NN2)cc1
InChIInChI=1S/C18H19Cl2N3O2/c1-2-25-12-8-6-11(7-9-12)15-10-16(23-22-15)18(24)21-14-5-3-4-13(19)17(14)20/h3-9,15-16,22-23H,2,10H2,1H3,(H,21,24)
InChIKeyNLBUKLLUWGJAQI-UHFFFAOYSA-N
XLogP3.94
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.28
LogP ≤ 53.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-ethoxyphenyl)-N-(2-methoxyphenyl)pyrazolidine-3-carboxamide
CID 75234255
N-[(2-chlorophenyl)methyl]-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
CID 75234440
1-N-(2,3-dichlorophenyl)-2-N-(4-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143544
5-(4-ethoxyphenyl)-N-(2,4,6-trimethylphenyl)pyrazolidine-3-carboxamide
CID 75234244
ethyl 3-[[5-(4-ethoxyphenyl)pyrazolidine-3-carbonyl]amino]benzoate
CID 75234280
5-(4-ethoxyphenyl)-N-[3-(trifluoromethoxy)phenyl]pyrazolidine-3-carboxamide
CID 75234301
N-(3,4-difluorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
CID 75254832
5-(2-chlorophenyl)-N-[(4-ethoxyphenyl)methyl]pyrazolidine-3-carboxamide
CID 75255164
N-[(2-chloro-4-fluorophenyl)methyl]-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
CID 75255208
N-[(4-bromophenyl)methyl]-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide
CID 75234443
1-N'-(2,3-dichlorophenyl)-1-N-(4-ethoxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108983179
5-[4-(2-methylpropoxy)phenyl]pyrazolidine-3-carbohydrazide
CID 78211548

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide (CID 75254833) is N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide is CCOc1ccc(C2CC(C(=O)Nc3cccc(Cl)c3Cl)NN2)cc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide?
The InChIKey is NLBUKLLUWGJAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2N3O2/c1-2-25-12-8-6-11(7-9-12)15-10-16(23-22-15)18(24)21-14-5-3-4-13(19)17(14)20/h3-9,15-16,22-23H,2,10H2,1H3,(H,21,24).
What are the key properties of N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide?
N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide has a molecular weight of 380.28 g/mol, XLogP of 3.94, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 75254833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).