N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide

C23H28N2O3 — CID 109056478

IUPACN-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(C(=O)N2CCCCC2CC)c1
InChIInChI=1S/C23H28N2O3/c1-3-19-12-7-8-15-25(19)23(27)18-11-9-10-17(16-18)22(26)24-20-13-5-6-14-21(20)28-4-2/h5-6,9-11,13-14,16,19H,3-4,7-8,12,15H2,1-2H3,(H,24,26)
InChIKeyIDDABSDOKMIWME-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.74
Rot. Bonds6

About N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide

N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide (PubChem CID 109056478) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
PubChem CID109056478
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC NameN-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(C(=O)N2CCCCC2CC)c1
InChIInChI=1S/C23H28N2O3/c1-3-19-12-7-8-15-25(19)23(27)18-11-9-10-17(16-18)22(26)24-20-13-5-6-14-21(20)28-4-2/h5-6,9-11,13-14,16,19H,3-4,7-8,12,15H2,1-2H3,(H,24,26)
InChIKeyIDDABSDOKMIWME-UHFFFAOYSA-N
XLogP4.74
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090246
3-(2-ethylpiperidine-1-carbonyl)-N-(2-methylphenyl)benzamide
CID 109056450
N-(2,3-dimethylphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056461
N-(2-ethoxyphenyl)-2-ethylpiperidine-1-carboxamide
CID 6468578
N-(2-ethoxyphenyl)-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109056550
5-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109107451
5-(2-ethylpiperidine-1-carbonyl)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109107457
N-(3-acetylphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056486
N-(3,4-dimethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056485
[5-(2-ethoxyanilino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109240550
3-(2-ethylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050358
3-(2-ethylpiperidine-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 109055463

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide?
The IUPAC name of N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide (CID 109056478) is N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide?
The canonical SMILES for N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide is CCOc1ccccc1NC(=O)c1cccc(C(=O)N2CCCCC2CC)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide?
The InChIKey is IDDABSDOKMIWME-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-3-19-12-7-8-15-25(19)23(27)18-11-9-10-17(16-18)22(26)24-20-13-5-6-14-21(20)28-4-2/h5-6,9-11,13-14,16,19H,3-4,7-8,12,15H2,1-2H3,(H,24,26).
What are the key properties of N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide?
N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide has a molecular weight of 380.49 g/mol, XLogP of 4.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109056478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).