3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide

C24H30N2O3 — CID 109055463

IUPAC3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
SMILESCCC1CCCCN1C(=O)c1cccc(C(=O)NCCc2ccccc2OC)c1
InChIInChI=1S/C24H30N2O3/c1-3-21-12-6-7-16-26(21)24(28)20-11-8-10-19(17-20)23(27)25-15-14-18-9-4-5-13-22(18)29-2/h4-5,8-11,13,17,21H,3,6-7,12,14-16H2,1-2H3,(H,25,27)
InChIKeyPDPYXRNVWUUFCA-UHFFFAOYSA-N
MW394.52 g/mol
LogP4.07
Rot. Bonds7

About 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide

3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide (PubChem CID 109055463) has the molecular formula C24H30N2O3 and a molecular weight of 394.52 g/mol. Its IUPAC name is 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
PubChem CID109055463
Molecular FormulaC24H30N2O3
Molecular Weight394.52 g/mol
Exact Mass394.23
IUPAC Name3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
SMILESCCC1CCCCN1C(=O)c1cccc(C(=O)NCCc2ccccc2OC)c1
InChIInChI=1S/C24H30N2O3/c1-3-21-12-6-7-16-26(21)24(28)20-11-8-10-19(17-20)23(27)25-15-14-18-9-4-5-13-22(18)29-2/h4-5,8-11,13,17,21H,3,6-7,12,14-16H2,1-2H3,(H,25,27)
InChIKeyPDPYXRNVWUUFCA-UHFFFAOYSA-N
XLogP4.07
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azepane-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 109055466
3-(2-ethylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050358
N-[2-(4-chlorophenyl)ethyl]-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109055680
N-(3,4-dimethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056485
N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056478
4-(2-ethylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047836
(2-ethylpiperidin-1-yl)-[2-[(2-methoxyphenyl)methylamino]pyrimidin-5-yl]methanone
CID 109257901
(2,6-dimethoxyphenyl)-[(2S)-2-ethylpiperidin-1-yl]methanone
CID 683288
N-[(2-methoxyphenyl)methyl]-3-(piperidine-1-carbonyl)benzamide
CID 109051991
3-(2-ethylpiperidine-1-carbonyl)-N-(2-methylphenyl)benzamide
CID 109056450
5-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109107451
1-N-[2-(2-methoxyphenyl)ethyl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
CID 109055465

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide?
The IUPAC name of 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide (CID 109055463) is 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide.
What is the SMILES notation for 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide?
The canonical SMILES for 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide is CCC1CCCCN1C(=O)c1cccc(C(=O)NCCc2ccccc2OC)c1.
What is the InChIKey of 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide?
The InChIKey is PDPYXRNVWUUFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O3/c1-3-21-12-6-7-16-26(21)24(28)20-11-8-10-19(17-20)23(27)25-15-14-18-9-4-5-13-22(18)29-2/h4-5,8-11,13,17,21H,3,6-7,12,14-16H2,1-2H3,(H,25,27).
What are the key properties of 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide?
3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide has a molecular weight of 394.52 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide is sourced from PubChem (CID 109055463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).