prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)

C100H121N15O19P2 — CID 91561079

About prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)

prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane) (PubChem CID 91561079) has the molecular formula C100H121N15O19P2 and a molecular weight of 1899.10 g/mol. Its IUPAC name is prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane).

Molecular Properties

• Compound Name: prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)
• PubChem CID: 91561079
• Molecular Formula: C100H121N15O19P2
• Molecular Weight: 1899.10 g/mol
• Exact Mass: 1897.84
• IUPAC Name: prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)
• SMILES: C=CCOC(=O)[C@H](CCC(=O)NC)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](O)NC(=O)C(C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](C)NC(=O)OCC1c2ccccc2-c2ccccc21.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/C64H91N15O19.2C18H15P/c1-14-28-97-63(95)46(25-26-48(80)65-13)77-57(89)37(9)72-53(85)33(5)69-54(86)36(8)74-60(92)61(93)78-58(90)38(10)73-59(91)47-24-19-27-79(47)62(94)40(12)75-55(87)35(7)70-51(83)32(4)67-49(81)30(2)66-50(82)31(3)68-52(84)34(6)71-56(88)39(11)76-64(96)98-29-45-43-22-17-15-20-41(43)42-21-16-18-23-44(42)45;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h14-18,20-23,30-40,45-47,61,93H,1,19,24-29H2,2-13H3,(H,65,80)(H,66,82)(H,67,81)(H,68,84)(H,69,86)(H,70,83)(H,71,88)(H,72,85)(H,73,91)(H,74,92)(H,75,87)(H,76,96)(H,77,89)(H,78,90);2*1-15H/t30?,31-,32-,33-,34?,35-,36?,37-,38?,39-,40-,46-,47-,61-;;/m0../s1
• InChIKey: ZXFTXWIDVWAYQN-LSIXGELPSA-N
• XLogP: 3.02
• TPSA: 483.47 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 19
• Rotatable Bonds: 40
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1899.10
LogP ≤ 5	3.02
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)?

The IUPAC name of prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane) (CID 91561079) is prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane).

What is the SMILES notation for prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)?

The canonical SMILES for prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane) is C=CCOC(=O)[C@H](CCC(=O)NC)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](O)NC(=O)C(C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](C)NC(=O)OCC1c2ccccc2-c2ccccc21.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.

What is the InChIKey of prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)?

The InChIKey is ZXFTXWIDVWAYQN-LSIXGELPSA-N. The full InChI is InChI=1S/C64H91N15O19.2C18H15P/c1-14-28-97-63(95)46(25-26-48(80)65-13)77-57(89)37(9)72-53(85)33(5)69-54(86)36(8)74-60(92)61(93)78-58(90)38(10)73-59(91)47-24-19-27-79(47)62(94)40(12)75-55(87)35(7)70-51(83)32(4)67-49(81)30(2)66-50(82)31(3)68-52(84)34(6)71-56(88)39(11)76-64(96)98-29-45-43-22-17-15-20-41(43)42-21-16-18-23-44(42)45;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h14-18,20-23,30-40,45-47,61,93H,1,19,24-29H2,2-13H3,(H,65,80)(H,66,82)(H,67,81)(H,68,84)(H,69,86)(H,70,83)(H,71,88)(H,72,85)(H,73,91)(H,74,92)(H,75,87)(H,76,96)(H,77,89)(H,78,90);2*1-15H/t30?,31-,32-,33-,34?,35-,36?,37-,38?,39-,40-,46-,47-,61-;;/m0../s1.

What are the key properties of prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane)?

prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane) has a molecular weight of 1899.10 g/mol, XLogP of 3.02, 40 rotatable bonds, 15 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-2-hydroxyacetyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]-5-(methylamino)-5-oxopentanoate;bis(triphenylphosphane) is sourced from PubChem (CID 91561079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).