4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide

C23H29N3O3 — CID 51170589

IUPAC4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
SMILESCCC1CCCCN1CC(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C23H29N3O3/c1-3-19-8-6-7-15-26(19)16-22(27)24-18-13-11-17(12-14-18)23(28)25-20-9-4-5-10-21(20)29-2/h4-5,9-14,19H,3,6-8,15-16H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyAOEHEQRSCJEVRN-UHFFFAOYSA-N
MW395.50 g/mol
LogP4.15
Rot. Bonds7

About 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide

4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide (PubChem CID 51170589) has the molecular formula C23H29N3O3 and a molecular weight of 395.50 g/mol. Its IUPAC name is 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
PubChem CID51170589
Molecular FormulaC23H29N3O3
Molecular Weight395.50 g/mol
Exact Mass395.22
IUPAC Name4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
SMILESCCC1CCCCN1CC(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C23H29N3O3/c1-3-19-8-6-7-15-26(19)16-22(27)24-18-13-11-17(12-14-18)23(28)25-20-9-4-5-10-21(20)29-2/h4-5,9-14,19H,3,6-8,15-16H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyAOEHEQRSCJEVRN-UHFFFAOYSA-N
XLogP4.15
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.50
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyphenyl)-4-[[2-(2-methylpiperidin-1-yl)acetyl]amino]benzamide
CID 16554821
4-[[2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 11940884
N-(4-acetylphenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 109006395
4-[(2-cyclopentylacetyl)amino]-N-(2-methoxyphenyl)benzamide
CID 9244990
[2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl] cyclopropanecarboxylate
CID 7863287
4-[[2-[cyclopentyl(methyl)amino]acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 16576369
N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
CID 43266257
N-(2-methoxyphenyl)-4-[[2-[3-(trifluoromethyl)piperidin-1-yl]acetyl]amino]benzamide
CID 46801583
2-(2-ethylpiperidin-1-yl)-N-(2-methylphenyl)acetamide
CID 78787228
N-(2-methoxyphenyl)-2-[2-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119928580
4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 2439104
(3S)-2-[2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 55935335

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide (CID 51170589) is 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide is CCC1CCCCN1CC(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1.
What is the InChIKey of 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
The InChIKey is AOEHEQRSCJEVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O3/c1-3-19-8-6-7-15-26(19)16-22(27)24-18-13-11-17(12-14-18)23(28)25-20-9-4-5-10-21(20)29-2/h4-5,9-14,19H,3,6-8,15-16H2,1-2H3,(H,24,27)(H,25,28).
What are the key properties of 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide has a molecular weight of 395.50 g/mol, XLogP of 4.15, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 51170589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).