N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium

C53H88N6O15Y — CID 157257399

About N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium

N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium (PubChem CID 157257399) has the molecular formula C53H88N6O15Y and a molecular weight of 1138.22 g/mol. Its IUPAC name is N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium.

Molecular Properties

• Compound Name: N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium
• PubChem CID: 157257399
• Molecular Formula: C53H88N6O15Y
• Molecular Weight: 1138.22 g/mol
• Exact Mass: 1137.54
• IUPAC Name: N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium
• SMILES: C.C.C.CC(C)(C)OC(=O)NCCOCCN.CC/C=C\CC(=O)NCCOCCNC(=O)c1ccccc1O.CC/C=C\CC(=O)O.NCCOCCNC(=O)c1ccccc1O.O=C(O)c1ccccc1O.[Y]
• InChI: InChI=1S/C17H24N2O4.C11H16N2O3.C9H20N2O3.C7H6O3.C6H10O2.3CH4.Y/c1-2-3-4-9-16(21)18-10-12-23-13-11-19-17(22)14-7-5-6-8-15(14)20;12-5-7-16-8-6-13-11(15)9-3-1-2-4-10(9)14;1-9(2,3)14-8(12)11-5-7-13-6-4-10;8-6-4-2-1-3-5(6)7(9)10;1-2-3-4-5-6(7)8;;;;/h3-8,20H,2,9-13H2,1H3,(H,18,21)(H,19,22);1-4,14H,5-8,12H2,(H,13,15);4-7,10H2,1-3H3,(H,11,12);1-4,8H,(H,9,10);3-4H,2,5H2,1H3,(H,7,8);3*1H4;/b4-3-;;;;4-3-
• InChIKey: AXAYRCZHWKRIFX-IHGZHKDBSA-N
• XLogP: 6.62
• TPSA: 340.65 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 15
• Rotatable Bonds: 25
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1138.22
LogP ≤ 5	6.62
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium?

The IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium (CID 157257399) is N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium.

What is the SMILES notation for N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium?

The canonical SMILES for N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium is C.C.C.CC(C)(C)OC(=O)NCCOCCN.CC/C=C\CC(=O)NCCOCCNC(=O)c1ccccc1O.CC/C=C\CC(=O)O.NCCOCCNC(=O)c1ccccc1O.O=C(O)c1ccccc1O.[Y].

What is the InChIKey of N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium?

The InChIKey is AXAYRCZHWKRIFX-IHGZHKDBSA-N. The full InChI is InChI=1S/C17H24N2O4.C11H16N2O3.C9H20N2O3.C7H6O3.C6H10O2.3CH4.Y/c1-2-3-4-9-16(21)18-10-12-23-13-11-19-17(22)14-7-5-6-8-15(14)20;12-5-7-16-8-6-13-11(15)9-3-1-2-4-10(9)14;1-9(2,3)14-8(12)11-5-7-13-6-4-10;8-6-4-2-1-3-5(6)7(9)10;1-2-3-4-5-6(7)8;;;;/h3-8,20H,2,9-13H2,1H3,(H,18,21)(H,19,22);1-4,14H,5-8,12H2,(H,13,15);4-7,10H2,1-3H3,(H,11,12);1-4,8H,(H,9,10);3-4H,2,5H2,1H3,(H,7,8);3*1H4;/b4-3-;;;;4-3-;;;;.

What are the key properties of N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium?

N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium has a molecular weight of 1138.22 g/mol, XLogP of 6.62, 25 rotatable bonds, 11 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(2-aminoethoxy)ethyl]-2-hydroxybenzamide;tert-butyl N-[2-(2-aminoethoxy)ethyl]carbamate;(Z)-hex-3-enoic acid;N-[2-[2-[[(Z)-hex-3-enoyl]amino]ethoxy]ethyl]-2-hydroxybenzamide;2-hydroxybenzoic acid;methane;yttrium is sourced from PubChem (CID 157257399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).