N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide

C20H25N3O3 — CID 113113542

IUPACN-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide
SMILESCCOc1ccccc1NC(=O)N1CCN(c2cccc(OC)c2)CC1
InChIInChI=1S/C20H25N3O3/c1-3-26-19-10-5-4-9-18(19)21-20(24)23-13-11-22(12-14-23)16-7-6-8-17(15-16)25-2/h4-10,15H,3,11-14H2,1-2H3,(H,21,24)
InChIKeyIGDZRPYAVLOJJC-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.45
Rot. Bonds5

About N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide

N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide (PubChem CID 113113542) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide
PubChem CID113113542
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide
SMILESCCOc1ccccc1NC(=O)N1CCN(c2cccc(OC)c2)CC1
InChIInChI=1S/C20H25N3O3/c1-3-26-19-10-5-4-9-18(19)21-20(24)23-13-11-22(12-14-23)16-7-6-8-17(15-16)25-2/h4-10,15H,3,11-14H2,1-2H3,(H,21,24)
InChIKeyIGDZRPYAVLOJJC-UHFFFAOYSA-N
XLogP3.45
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-4-phenylpiperazine-1-carboxamide
CID 108989544
4-(3-chloro-4-methoxyphenyl)-N-(2-ethoxyphenyl)piperazine-1-carboxamide
CID 113113405
4-(3,5-dimethylphenyl)-N-(2-ethoxyphenyl)piperazine-1-carboxamide
CID 113111741
N-(2-ethoxyphenyl)-3-(3-methoxyphenoxy)azetidine-1-carboxamide
CID 131927828
N-[2-(2-methoxyethoxy)phenyl]-4-(3-methylphenyl)piperazine-1-carboxamide
CID 47493667
N-(3-methoxyphenyl)-4-phenylpiperazine-1-carboxamide
CID 6469276
methyl 3-[4-[(2-methoxyphenyl)carbamoyl]piperazin-1-yl]benzoate
CID 113113513
methyl 2-[4-[(2-ethoxyphenyl)carbamoyl]piperazin-1-yl]benzoate
CID 113113699
N-(2-ethoxyphenyl)-4-formylpiperazine-1-carboxamide
CID 108988617
N-(2,4-dimethoxyphenyl)-4-(3-fluorophenyl)piperazine-1-carboxamide
CID 113114029
4-cyclopropylidene-N-(2-ethoxyphenyl)piperidine-1-carboxamide
CID 121187160
4-(2,5-dimethoxyphenyl)-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 113113504

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide (CID 113113542) is N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide is CCOc1ccccc1NC(=O)N1CCN(c2cccc(OC)c2)CC1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide?
The InChIKey is IGDZRPYAVLOJJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-3-26-19-10-5-4-9-18(19)21-20(24)23-13-11-22(12-14-23)16-7-6-8-17(15-16)25-2/h4-10,15H,3,11-14H2,1-2H3,(H,21,24).
What are the key properties of N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide?
N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 113113542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).