N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide

C25H32N4O2 — CID 34734655

IUPACN-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide
SMILESCc1cccc(N2CCN(CC(=O)Nc3ccccc3C(=O)NC3CCCC3)CC2)c1
InChIInChI=1S/C25H32N4O2/c1-19-7-6-10-21(17-19)29-15-13-28(14-16-29)18-24(30)27-23-12-5-4-11-22(23)25(31)26-20-8-2-3-9-20/h4-7,10-12,17,20H,2-3,8-9,13-16,18H2,1H3,(H,26,31)(H,27,30)
InChIKeyPIZQOJNXGFYRKW-UHFFFAOYSA-N
MW420.56 g/mol
LogP3.43
Rot. Bonds6

About N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide

N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide (PubChem CID 34734655) has the molecular formula C25H32N4O2 and a molecular weight of 420.56 g/mol. Its IUPAC name is N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide
PubChem CID34734655
Molecular FormulaC25H32N4O2
Molecular Weight420.56 g/mol
Exact Mass420.25
IUPAC NameN-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide
SMILESCc1cccc(N2CCN(CC(=O)Nc3ccccc3C(=O)NC3CCCC3)CC2)c1
InChIInChI=1S/C25H32N4O2/c1-19-7-6-10-21(17-19)29-15-13-28(14-16-29)18-24(30)27-23-12-5-4-11-22(23)25(31)26-20-8-2-3-9-20/h4-7,10-12,17,20H,2-3,8-9,13-16,18H2,1H3,(H,26,31)(H,27,30)
InChIKeyPIZQOJNXGFYRKW-UHFFFAOYSA-N
XLogP3.43
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.56
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]benzamide
CID 8688467
N-(4-fluorophenyl)-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide
CID 34735668
N-cyclopropyl-2-[[2-[4-(3-nitrophenyl)piperazin-1-yl]acetyl]amino]benzamide
CID 55841828
N-(2-tert-butylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 34736252
2-[[2-[4-(2-chlorophenyl)piperazin-1-yl]acetyl]amino]-N-cyclopropylbenzamide
CID 8704585
N-(5-chloro-2-methylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 34731945
N-cyclopropyl-2-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30649285
N-cyclopropyl-2-[(2-morpholin-4-ylacetyl)amino]benzamide
CID 2697520
N-(2,6-dimethylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 34731939
N-cyclohexyl-2-[3-[(3-methylbenzoyl)amino]propanoylamino]benzamide
CID 17191566
2-[[2-[4-(4-cyanophenyl)-1,4-diazepan-1-yl]acetyl]amino]-N-(3-methylphenyl)benzamide
CID 55850964
N-cyclopentyl-2-[(2-methylsulfanylacetyl)amino]benzamide
CID 26084225

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide?
The IUPAC name of N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide (CID 34734655) is N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide?
The canonical SMILES for N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide is Cc1cccc(N2CCN(CC(=O)Nc3ccccc3C(=O)NC3CCCC3)CC2)c1.
What is the InChIKey of N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide?
The InChIKey is PIZQOJNXGFYRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N4O2/c1-19-7-6-10-21(17-19)29-15-13-28(14-16-29)18-24(30)27-23-12-5-4-11-22(23)25(31)26-20-8-2-3-9-20/h4-7,10-12,17,20H,2-3,8-9,13-16,18H2,1H3,(H,26,31)(H,27,30).
What are the key properties of N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide?
N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide has a molecular weight of 420.56 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]amino]benzamide is sourced from PubChem (CID 34734655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).