2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide

C23H35N3O3 — CID 24719892

IUPAC2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide
SMILESCCCN(C)C(=O)C(C1CCCC1)N1CCN(C(=O)c2ccccc2OC)CC1
InChIInChI=1S/C23H35N3O3/c1-4-13-24(2)23(28)21(18-9-5-6-10-18)25-14-16-26(17-15-25)22(27)19-11-7-8-12-20(19)29-3/h7-8,11-12,18,21H,4-6,9-10,13-17H2,1-3H3
InChIKeyMDEIOMNULBEOGT-UHFFFAOYSA-N
MW401.55 g/mol
LogP2.88
Rot. Bonds7

About 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide

2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide (PubChem CID 24719892) has the molecular formula C23H35N3O3 and a molecular weight of 401.55 g/mol. Its IUPAC name is 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide.

Molecular Properties

Compound Name2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide
PubChem CID24719892
Molecular FormulaC23H35N3O3
Molecular Weight401.55 g/mol
Exact Mass401.27
IUPAC Name2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide
SMILESCCCN(C)C(=O)C(C1CCCC1)N1CCN(C(=O)c2ccccc2OC)CC1
InChIInChI=1S/C23H35N3O3/c1-4-13-24(2)23(28)21(18-9-5-6-10-18)25-14-16-26(17-15-25)22(27)19-11-7-8-12-20(19)29-3/h7-8,11-12,18,21H,4-6,9-10,13-17H2,1-3H3
InChIKeyMDEIOMNULBEOGT-UHFFFAOYSA-N
XLogP2.88
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.55
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-cyclopentyl-N-ethyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methylacetamide
CID 93208786
2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methylacetamide
CID 42682704
2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-ethyl-N-methylacetamide
CID 46024140
(2R)-2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-methoxybenzoyl)piperazin-1-yl]acetamide
CID 93209043
2-cyclopentyl-2-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-methyl-N-propylacetamide
CID 24719893
2-cyclopentyl-N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-methylbenzoyl)piperazin-1-yl]acetamide
CID 46024701
(4-cyclopentylpiperazin-1-yl)-(2-methoxyphenyl)methanone
CID 796432
(2R)-2-cyclopentyl-N,N-diethyl-2-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]acetamide
CID 93208283
N-benzyl-2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-N-methylacetamide
CID 42842361
2-cyclopentyl-N-ethyl-2-[4-(2-methylbenzoyl)piperazin-1-yl]acetamide
CID 46024730
(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone
CID 5149560
(2-methoxyphenyl)-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63248507

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide?
The IUPAC name of 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide (CID 24719892) is 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide.
What is the SMILES notation for 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide?
The canonical SMILES for 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide is CCCN(C)C(=O)C(C1CCCC1)N1CCN(C(=O)c2ccccc2OC)CC1.
What is the InChIKey of 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide?
The InChIKey is MDEIOMNULBEOGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O3/c1-4-13-24(2)23(28)21(18-9-5-6-10-18)25-14-16-26(17-15-25)22(27)19-11-7-8-12-20(19)29-3/h7-8,11-12,18,21H,4-6,9-10,13-17H2,1-3H3.
What are the key properties of 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide?
2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide has a molecular weight of 401.55 g/mol, XLogP of 2.88, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]-N-methyl-N-propylacetamide is sourced from PubChem (CID 24719892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).