3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide

C20H24N2O4 — CID 4958095

IUPAC3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
SMILESCCOc1cccc(C(=O)NCCNC(=O)c2cccc(OCC)c2)c1
InChIInChI=1S/C20H24N2O4/c1-3-25-17-9-5-7-15(13-17)19(23)21-11-12-22-20(24)16-8-6-10-18(14-16)26-4-2/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyUBBHDKSRXIODPN-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.64
Rot. Bonds9

About 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide

3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide (PubChem CID 4958095) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
PubChem CID4958095
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
SMILESCCOc1cccc(C(=O)NCCNC(=O)c2cccc(OCC)c2)c1
InChIInChI=1S/C20H24N2O4/c1-3-25-17-9-5-7-15(13-17)19(23)21-11-12-22-20(24)16-8-6-10-18(14-16)26-4-2/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyUBBHDKSRXIODPN-UHFFFAOYSA-N
XLogP2.64
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-ethoxy-N-[3-[(3-ethoxybenzoyl)amino]propyl]benzamide
CID 4958099
3-ethoxy-N-[2-(methylamino)ethyl]benzamide;hydrochloride
CID 119502998
3-propoxy-N-[2-[(3-propoxybenzoyl)amino]ethyl]benzamide
CID 4960567
N-(3-aminopropyl)-3-ethoxybenzamide;hydrochloride
CID 119407722
2-[2-[(3-ethoxybenzoyl)amino]ethoxy]propanoic acid
CID 110495239
3-ethoxy-N-prop-2-enylbenzamide
CID 4957446
N-[2-[(4-ethoxybenzoyl)amino]ethyl]-3-hydroxybenzamide
CID 108540575
3-propoxy-N-[3-[(3-propoxybenzoyl)amino]propyl]benzamide
CID 4960565
N-[2-(ethylamino)ethyl]-3-(2-methoxyethoxy)benzamide
CID 119504539
N-[2-(3-ethoxyphenoxy)ethyl]-3,5-dimethoxybenzamide
CID 113100586
N-[2-(ethylamino)ethyl]-3-propoxybenzamide
CID 62919691
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide
CID 4958088

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide?
The IUPAC name of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide (CID 4958095) is 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide.
What is the SMILES notation for 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide?
The canonical SMILES for 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide is CCOc1cccc(C(=O)NCCNC(=O)c2cccc(OCC)c2)c1.
What is the InChIKey of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide?
The InChIKey is UBBHDKSRXIODPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-25-17-9-5-7-15(13-17)19(23)21-11-12-22-20(24)16-8-6-10-18(14-16)26-4-2/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide?
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide has a molecular weight of 356.42 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide is sourced from PubChem (CID 4958095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).