N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide

C19H23N3O2 — CID 30938006

IUPACN-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCN(c3ccccc3C)CC2)cc1
InChIInChI=1S/C19H23N3O2/c1-15-5-3-4-6-18(15)21-11-13-22(14-12-21)19(23)20-16-7-9-17(24-2)10-8-16/h3-10H,11-14H2,1-2H3,(H,20,23)
InChIKeyKSJJMSFVTDSBBA-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.36
Rot. Bonds3

About N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide

N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide (PubChem CID 30938006) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide
PubChem CID30938006
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCN(c3ccccc3C)CC2)cc1
InChIInChI=1S/C19H23N3O2/c1-15-5-3-4-6-18(15)21-11-13-22(14-12-21)19(23)20-16-7-9-17(24-2)10-8-16/h3-10H,11-14H2,1-2H3,(H,20,23)
InChIKeyKSJJMSFVTDSBBA-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

methyl 4-[[4-(2-methylphenyl)piperazine-1-carbonyl]amino]benzoate
CID 113111065
4-(2,6-dimethylphenyl)-N-(4-methoxyphenyl)piperazine-1-carboxamide
CID 3688554
methyl 2-[4-[(4-methoxyphenyl)carbamoyl]piperazin-1-yl]benzoate
CID 113113629
N-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide
CID 113111056
N-(4-methoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-yl]acetamide
CID 3155501
4-(2-methylphenyl)-N-(4-piperidin-1-ylphenyl)piperazine-1-carboxamide
CID 113111071
N-(3-bromo-4-methylphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide
CID 113111047
4-(3,5-dimethylphenyl)-N-(4-methoxyphenyl)piperazine-1-carboxamide
CID 113111740
4-(4-methoxyphenyl)-N-(2-methylphenyl)piperazine-1-carboxamide
CID 6460818
2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
CID 8910906
4-(3-chloro-4-methylphenyl)-N-(4-methoxyphenyl)piperazine-1-carboxamide
CID 113113244
4-(2,4-dimethoxyphenyl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide
CID 3338318

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide (CID 30938006) is N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide is COc1ccc(NC(=O)N2CCN(c3ccccc3C)CC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide?
The InChIKey is KSJJMSFVTDSBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-15-5-3-4-6-18(15)21-11-13-22(14-12-21)19(23)20-16-7-9-17(24-2)10-8-16/h3-10H,11-14H2,1-2H3,(H,20,23).
What are the key properties of N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide?
N-(4-methoxyphenyl)-4-(2-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 N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 30938006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).