2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride

C24H35ClN4O2 — CID 67704353

IUPAC2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride
SMILESCCCNc1cc(C)cc(C(=O)N(C)C)c1N1CCN(c2ccccc2OC)CC1.Cl
InChIInChI=1S/C24H34N4O2.ClH/c1-6-11-25-20-17-18(2)16-19(24(29)26(3)4)23(20)28-14-12-27(13-15-28)21-9-7-8-10-22(21)30-5;/h7-10,16-17,25H,6,11-15H2,1-5H3;1H
InChIKeyLIDJAFUEBYRORD-UHFFFAOYSA-N
MW447.02 g/mol
LogP4.28
Rot. Bonds7

About 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride

2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride (PubChem CID 67704353) has the molecular formula C24H35ClN4O2 and a molecular weight of 447.02 g/mol. Its IUPAC name is 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride.

Molecular Properties

Compound Name2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride
PubChem CID67704353
Molecular FormulaC24H35ClN4O2
Molecular Weight447.02 g/mol
Exact Mass446.24
IUPAC Name2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride
SMILESCCCNc1cc(C)cc(C(=O)N(C)C)c1N1CCN(c2ccccc2OC)CC1.Cl
InChIInChI=1S/C24H34N4O2.ClH/c1-6-11-25-20-17-18(2)16-19(24(29)26(3)4)23(20)28-14-12-27(13-15-28)21-9-7-8-10-22(21)30-5;/h7-10,16-17,25H,6,11-15H2,1-5H3;1H
InChIKeyLIDJAFUEBYRORD-UHFFFAOYSA-N
XLogP4.28
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.02
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N-dimethyl-2-(propylamino)benzamide;hydrochloride
CID 22371024
2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]-N,N-dimethylbenzamide
CID 22458090
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N-dimethyl-3-propoxybenzamide
CID 67704305
N,N,5-trimethyl-3-[4-(2-nitrophenyl)piperazin-1-yl]-2-(propylamino)benzamide;hydrochloride
CID 67704476
3-(2-methoxy-5-methylanilino)-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
CID 47877476
5-chloro-2-[[4-(2-methoxyphenyl)piperazin-1-yl]-propylamino]-N,N-dimethylbenzamide;hydrochloride
CID 67704422
2-(2,5-dimethylanilino)-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
CID 109004130
6-[4-(4-fluoro-2-methoxyphenyl)piperazin-1-yl]-N,N-dimethyl-2-(propylamino)pyridine-3-carboxamide
CID 67704408
2-[4-(4-hydroxy-2-methoxyphenyl)piperazin-1-yl]-N,N-dimethyl-4-(propylamino)pyridine-3-carboxamide;hydrochloride
CID 67704456
4-(2-methoxyphenyl)-N,N-dimethyl-3-piperazin-1-yl-2-(propylamino)benzamide
CID 22370979
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2,4,6-trimethylbenzamide
CID 42266869
6-chloro-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethylpyridine-3-carboxamide;hydrochloride
CID 21473425

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride?
The IUPAC name of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride (CID 67704353) is 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride.
What is the SMILES notation for 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride?
The canonical SMILES for 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride is CCCNc1cc(C)cc(C(=O)N(C)C)c1N1CCN(c2ccccc2OC)CC1.Cl.
What is the InChIKey of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride?
The InChIKey is LIDJAFUEBYRORD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N4O2.ClH/c1-6-11-25-20-17-18(2)16-19(24(29)26(3)4)23(20)28-14-12-27(13-15-28)21-9-7-8-10-22(21)30-5;/h7-10,16-17,25H,6,11-15H2,1-5H3;1H.
What are the key properties of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride?
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride has a molecular weight of 447.02 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N,5-trimethyl-3-(propylamino)benzamide;hydrochloride is sourced from PubChem (CID 67704353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).