3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide

C24H36N2O4 — CID 24818955

IUPAC3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide
SMILESCOc1ccc(C(=O)N(C)CCCC2CCCC2)cc1OC1CCN(C(C)=O)CC1
InChIInChI=1S/C24H36N2O4/c1-18(27)26-15-12-21(13-16-26)30-23-17-20(10-11-22(23)29-3)24(28)25(2)14-6-9-19-7-4-5-8-19/h10-11,17,19,21H,4-9,12-16H2,1-3H3
InChIKeyDKXMFTIBGWJXQM-UHFFFAOYSA-N
MW416.56 g/mol
LogP4.13
Rot. Bonds8

About 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide

3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide (PubChem CID 24818955) has the molecular formula C24H36N2O4 and a molecular weight of 416.56 g/mol. Its IUPAC name is 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide
PubChem CID24818955
Molecular FormulaC24H36N2O4
Molecular Weight416.56 g/mol
Exact Mass416.27
IUPAC Name3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide
SMILESCOc1ccc(C(=O)N(C)CCCC2CCCC2)cc1OC1CCN(C(C)=O)CC1
InChIInChI=1S/C24H36N2O4/c1-18(27)26-15-12-21(13-16-26)30-23-17-20(10-11-22(23)29-3)24(28)25(2)14-6-9-19-7-4-5-8-19/h10-11,17,19,21H,4-9,12-16H2,1-3H3
InChIKeyDKXMFTIBGWJXQM-UHFFFAOYSA-N
XLogP4.13
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.56
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-acetylpiperidin-4-yl)oxy-4-methoxy-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 24792003
3-(1-acetylpiperidin-4-yl)oxy-N-(2-hydroxy-2-phenylethyl)-4-methoxy-N-methylbenzamide
CID 24817343
4-(1-cyclopentylpiperidin-4-yl)oxy-3-methoxy-N-(2-methoxyethyl)-N-methylbenzamide
CID 25491681
4-cyclopentyloxy-3-methoxy-N-methyl-N-(2-oxopropyl)benzamide
CID 130184757
4-(1-acetylpiperidin-4-yl)oxy-3-methoxy-N,N-bis(prop-2-enyl)benzamide
CID 23723924
3-(1-acetylpiperidin-4-yl)oxy-4-methoxy-N-methyl-N-[(1R)-1-(1,3-thiazol-2-yl)ethyl]benzamide
CID 25366984
3-(1-cycloheptylpiperidin-4-yl)oxy-N-[2-(dimethylamino)ethyl]-4-methoxybenzamide
CID 26408301
4-methoxy-N-methyl-N-(oxan-2-ylmethyl)-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide
CID 45194364
N-(5-chloropentyl)-3,4-dimethoxy-N-methylbenzamide
CID 107205814
1-[3-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-1-yl]ethanone
CID 10266977
1-[4-[5-(3,4-dimethylpiperazine-1-carbonyl)-2-methoxyphenoxy]piperidin-1-yl]ethanone
CID 24819154
4-(1-cyclopentylpiperidin-4-yl)oxy-3-methoxy-N-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]benzamide
CID 25375156

Frequently Asked Questions

What is the IUPAC name of 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide?
The IUPAC name of 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide (CID 24818955) is 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide.
What is the SMILES notation for 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide?
The canonical SMILES for 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide is COc1ccc(C(=O)N(C)CCCC2CCCC2)cc1OC1CCN(C(C)=O)CC1.
What is the InChIKey of 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide?
The InChIKey is DKXMFTIBGWJXQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36N2O4/c1-18(27)26-15-12-21(13-16-26)30-23-17-20(10-11-22(23)29-3)24(28)25(2)14-6-9-19-7-4-5-8-19/h10-11,17,19,21H,4-9,12-16H2,1-3H3.
What are the key properties of 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide?
3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide has a molecular weight of 416.56 g/mol, XLogP of 4.13, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-acetylpiperidin-4-yl)oxy-N-(3-cyclopentylpropyl)-4-methoxy-N-methylbenzamide is sourced from PubChem (CID 24818955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).