4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide

C19H23N3O2 — CID 16645833

IUPAC4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
SMILESCOc1cccc(N2CCN(C(=O)Nc3cccc(C)c3)CC2)c1
InChIInChI=1S/C19H23N3O2/c1-15-5-3-6-16(13-15)20-19(23)22-11-9-21(10-12-22)17-7-4-8-18(14-17)24-2/h3-8,13-14H,9-12H2,1-2H3,(H,20,23)
InChIKeyHRZWTSQJLYPIBW-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.36
Rot. Bonds3

About 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide

4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide (PubChem CID 16645833) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
PubChem CID16645833
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
SMILESCOc1cccc(N2CCN(C(=O)Nc3cccc(C)c3)CC2)c1
InChIInChI=1S/C19H23N3O2/c1-15-5-3-6-16(13-15)20-19(23)22-11-9-21(10-12-22)17-7-4-8-18(14-17)24-2/h3-8,13-14H,9-12H2,1-2H3,(H,20,23)
InChIKeyHRZWTSQJLYPIBW-UHFFFAOYSA-N
XLogP3.36
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxyphenyl)-4-phenylpiperazine-1-carboxamide
CID 6469276
4-(3-cyanophenyl)-N-(3-methoxyphenyl)piperazine-1-carboxamide
CID 113113611
N-(3-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 2982408
N-(3-methylphenyl)-4-(4-piperidin-1-ylphenyl)piperazine-1-carboxamide
CID 113111218
4-(3-methylphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carboxamide
CID 108866738
4-(3-cyanophenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
CID 113111248
4-(3-methylphenyl)-N-(3-pyrrol-1-ylphenyl)piperazine-1-carboxamide
CID 56505268
4-(4-chlorophenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
CID 851976
N-(3-methoxyphenyl)-4-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 113113577
4-[1-(3-methoxyphenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]-N-(3-methylphenyl)piperazine-1-carboxamide
CID 42666320
N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylpiperazine-1-carboxamide
CID 53370700
4-[(4-methoxyphenyl)methyl]-N-(3-methylphenyl)piperazine-1-carboxamide
CID 17184547

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide?
The IUPAC name of 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide (CID 16645833) is 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide is COc1cccc(N2CCN(C(=O)Nc3cccc(C)c3)CC2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide?
The InChIKey is HRZWTSQJLYPIBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-15-5-3-6-16(13-15)20-19(23)22-11-9-21(10-12-22)17-7-4-8-18(14-17)24-2/h3-8,13-14H,9-12H2,1-2H3,(H,20,23).
What are the key properties of 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide?
4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 16645833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).