N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide

C19H22ClN3O3 — CID 2741700

IUPACN-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)N1CCN(c2ccccc2OC)CC1
InChIInChI=1S/C19H22ClN3O3/c1-25-17-8-7-14(20)13-15(17)21-19(24)23-11-9-22(10-12-23)16-5-3-4-6-18(16)26-2/h3-8,13H,9-12H2,1-2H3,(H,21,24)
InChIKeyNIEZNVXRIAQDDO-UHFFFAOYSA-N
MW375.86 g/mol
LogP3.71
Rot. Bonds4

About N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide

N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide (PubChem CID 2741700) has the molecular formula C19H22ClN3O3 and a molecular weight of 375.86 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide
PubChem CID2741700
Molecular FormulaC19H22ClN3O3
Molecular Weight375.86 g/mol
Exact Mass375.13
IUPAC NameN-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)N1CCN(c2ccccc2OC)CC1
InChIInChI=1S/C19H22ClN3O3/c1-25-17-8-7-14(20)13-15(17)21-19(24)23-11-9-22(10-12-23)16-5-3-4-6-18(16)26-2/h3-8,13H,9-12H2,1-2H3,(H,21,24)
InChIKeyNIEZNVXRIAQDDO-UHFFFAOYSA-N
XLogP3.71
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.86
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide (CID 2741700) is N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide is COc1ccc(Cl)cc1NC(=O)N1CCN(c2ccccc2OC)CC1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide?
The InChIKey is NIEZNVXRIAQDDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O3/c1-25-17-8-7-14(20)13-15(17)21-19(24)23-11-9-22(10-12-23)16-5-3-4-6-18(16)26-2/h3-8,13H,9-12H2,1-2H3,(H,21,24).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide?
N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide has a molecular weight of 375.86 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-4-(2-methoxyphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 2741700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).