N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene

C77H131N11O38Si3 — CID 160570841

IUPACN-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene
SMILESC=CC.COCCOCCC(=O)NCCC[Si](O)(O)OC.COCCOCCC(=O)ON1C(=O)CCC1=O.CO[Si](O)(O)CCCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O.CO[Si](O)(O)CCCNC(=O)CCOCCOCCNCCCN1C(=O)C=CC1=O.O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O
InChIInChI=1S/C18H31N3O9Si.C18H23N3O9.C18H33N3O8Si.C10H23NO6Si.C10H15NO6.C3H6/c1-28-31(26,27)14-2-7-19-16(23)6-10-29-12-13-30-11-8-20-15(22)5-9-21-17(24)3-4-18(21)25;22-13(5-8-20-14(23)1-2-15(20)24)19-7-10-29-12-11-28-9-6-18(27)30-21-16(25)3-4-17(21)26;1-27-30(25,26)15-3-8-20-16(22)6-11-28-13-14-29-12-9-19-7-2-10-21-17(23)4-5-18(21)24;1-15-7-8-17-6-4-10(12)11-5-3-9-18(13,14)16-2;1-15-6-7-16-5-4-10(14)17-11-8(12)2-3-9(11)13;1-3-2/h3-4,26-27H,2,5-14H2,1H3,(H,19,23)(H,20,22);1-2H,3-12H2,(H,19,22);4-5,19,25-26H,2-3,6-15H2,1H3,(H,20,22);13-14H,3-9H2,1-2H3,(H,11,12);2-7H2,1H3;3H,1H2,2H3
InChIKeyRANJCELOIABZQA-UHFFFAOYSA-N
MW1903.19 g/mol
LogP-5.29
Rot. Bonds66

About N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene

N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene (PubChem CID 160570841) has the molecular formula C77H131N11O38Si3 and a molecular weight of 1903.19 g/mol. Its IUPAC name is N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene.

Molecular Properties

Compound NameN-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene
PubChem CID160570841
Molecular FormulaC77H131N11O38Si3
Molecular Weight1903.19 g/mol
Exact Mass1901.80
IUPAC NameN-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene
SMILESC=CC.COCCOCCC(=O)NCCC[Si](O)(O)OC.COCCOCCC(=O)ON1C(=O)CCC1=O.CO[Si](O)(O)CCCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O.CO[Si](O)(O)CCCNC(=O)CCOCCOCCNCCCN1C(=O)C=CC1=O.O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O
InChIInChI=1S/C18H31N3O9Si.C18H23N3O9.C18H33N3O8Si.C10H23NO6Si.C10H15NO6.C3H6/c1-28-31(26,27)14-2-7-19-16(23)6-10-29-12-13-30-11-8-20-15(22)5-9-21-17(24)3-4-18(21)25;22-13(5-8-20-14(23)1-2-15(20)24)19-7-10-29-12-11-28-9-6-18(27)30-21-16(25)3-4-17(21)26;1-27-30(25,26)15-3-8-20-16(22)6-11-28-13-14-29-12-9-19-7-2-10-21-17(23)4-5-18(21)24;1-15-7-8-17-6-4-10(12)11-5-3-9-18(13,14)16-2;1-15-6-7-16-5-4-10(14)17-11-8(12)2-3-9(11)13;1-3-2/h3-4,26-27H,2,5-14H2,1H3,(H,19,23)(H,20,22);1-2H,3-12H2,(H,19,22);4-5,19,25-26H,2-3,6-15H2,1H3,(H,20,22);13-14H,3-9H2,1-2H3,(H,11,12);2-7H2,1H3;3H,1H2,2H3
InChIKeyRANJCELOIABZQA-UHFFFAOYSA-N
XLogP-5.29
TPSA638.40 Ų
H-Bond Donors12
H-Bond Acceptors39
Rotatable Bonds66
Heavy Atoms129
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001903.19
LogP ≤ 5-5.29
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

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

Analyze N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene?
The IUPAC name of N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene (CID 160570841) is N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene.
What is the SMILES notation for N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene?
The canonical SMILES for N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene is C=CC.COCCOCCC(=O)NCCC[Si](O)(O)OC.COCCOCCC(=O)ON1C(=O)CCC1=O.CO[Si](O)(O)CCCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O.CO[Si](O)(O)CCCNC(=O)CCOCCOCCNCCCN1C(=O)C=CC1=O.O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O.
What is the InChIKey of N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene?
The InChIKey is RANJCELOIABZQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O9Si.C18H23N3O9.C18H33N3O8Si.C10H23NO6Si.C10H15NO6.C3H6/c1-28-31(26,27)14-2-7-19-16(23)6-10-29-12-13-30-11-8-20-15(22)5-9-21-17(24)3-4-18(21)25;22-13(5-8-20-14(23)1-2-15(20)24)19-7-10-29-12-11-28-9-6-18(27)30-21-16(25)3-4-17(21)26;1-27-30(25,26)15-3-8-20-16(22)6-11-28-13-14-29-12-9-19-7-2-10-21-17(23)4-5-18(21)24;1-15-7-8-17-6-4-10(12)11-5-3-9-18(13,14)16-2;1-15-6-7-16-5-4-10(14)17-11-8(12)2-3-9(11)13;1-3-2/h3-4,26-27H,2,5-14H2,1H3,(H,19,23)(H,20,22);1-2H,3-12H2,(H,19,22);4-5,19,25-26H,2-3,6-15H2,1H3,(H,20,22);13-14H,3-9H2,1-2H3,(H,11,12);2-7H2,1H3;3H,1H2,2H3.
What are the key properties of N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene?
N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene has a molecular weight of 1903.19 g/mol, XLogP of -5.29, 66 rotatable bonds, 12 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[3-[3-[dihydroxy(methoxy)silyl]propylamino]-3-oxopropoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propylamino]ethoxy]ethoxy]propanamide;N-[3-[dihydroxy(methoxy)silyl]propyl]-3-(2-methoxyethoxy)propanamide;(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]propanoate;(2,5-dioxopyrrolidin-1-yl) 3-(2-methoxyethoxy)propanoate;prop-1-ene is sourced from PubChem (CID 160570841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).