8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide

C70H137N5O21 — CID 162031246

About 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide

8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide (PubChem CID 162031246) has the molecular formula C70H137N5O21 and a molecular weight of 1384.88 g/mol. Its IUPAC name is 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide.

Molecular Properties

• Compound Name: 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide
• PubChem CID: 162031246
• Molecular Formula: C70H137N5O21
• Molecular Weight: 1384.88 g/mol
• Exact Mass: 1383.98
• IUPAC Name: 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide
• SMILES: CC(C)[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1NC(=O)CCCCCCCN.CC(C)[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1NC(=O)CCCCCCCO.CCCCCCCC(=O)NC1[C@H](C(C)C)OC(CO)[C@@H](O)[C@@H]1O.CCCCCCCCCC(=O)NC1[C@H](C(C)C)OC(CO)[C@@H](O)[C@@H]1O
• InChI: InChI=1S/C19H37NO5.C17H34N2O5.C17H33NO6.C17H33NO5/c1-4-5-6-7-8-9-10-11-15(22)20-16-18(24)17(23)14(12-21)25-19(16)13(2)3;1-11(2)17-14(16(23)15(22)12(10-20)24-17)19-13(21)8-6-4-3-5-7-9-18;1-11(2)17-14(16(23)15(22)12(10-20)24-17)18-13(21)8-6-4-3-5-7-9-19;1-4-5-6-7-8-9-13(20)18-14-16(22)15(21)12(10-19)23-17(14)11(2)3/h13-14,16-19,21,23-24H,4-12H2,1-3H3,(H,20,22);11-12,14-17,20,22-23H,3-10,18H2,1-2H3,(H,19,21);11-12,14-17,19-20,22-23H,3-10H2,1-2H3,(H,18,21);11-12,14-17,19,21-22H,4-10H2,1-3H3,(H,18,20)/t14?,16?,17-,18-,19+;3*12?,14?,15-,16-,17+/m1111/s1
• InChIKey: YWAXSNJGEWYPOH-FIAYWXPFSA-N
• XLogP: 2.57
• TPSA: 442.33 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 22
• Rotatable Bonds: 40
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1384.88
LogP ≤ 5	2.57
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide?

The IUPAC name of 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide (CID 162031246) is 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide.

What is the SMILES notation for 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide?

The canonical SMILES for 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide is CC(C)[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1NC(=O)CCCCCCCN.CC(C)[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1NC(=O)CCCCCCCO.CCCCCCCC(=O)NC1[C@H](C(C)C)OC(CO)[C@@H](O)[C@@H]1O.CCCCCCCCCC(=O)NC1[C@H](C(C)C)OC(CO)[C@@H](O)[C@@H]1O.

What is the InChIKey of 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide?

The InChIKey is YWAXSNJGEWYPOH-FIAYWXPFSA-N. The full InChI is InChI=1S/C19H37NO5.C17H34N2O5.C17H33NO6.C17H33NO5/c1-4-5-6-7-8-9-10-11-15(22)20-16-18(24)17(23)14(12-21)25-19(16)13(2)3;1-11(2)17-14(16(23)15(22)12(10-20)24-17)19-13(21)8-6-4-3-5-7-9-18;1-11(2)17-14(16(23)15(22)12(10-20)24-17)18-13(21)8-6-4-3-5-7-9-19;1-4-5-6-7-8-9-13(20)18-14-16(22)15(21)12(10-19)23-17(14)11(2)3/h13-14,16-19,21,23-24H,4-12H2,1-3H3,(H,20,22);11-12,14-17,20,22-23H,3-10,18H2,1-2H3,(H,19,21);11-12,14-17,19-20,22-23H,3-10H2,1-2H3,(H,18,21);11-12,14-17,19,21-22H,4-10H2,1-3H3,(H,18,20)/t14?,16?,17-,18-,19+;3*12?,14?,15-,16-,17+/m1111/s1.

What are the key properties of 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide?

8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide has a molecular weight of 1384.88 g/mol, XLogP of 2.57, 40 rotatable bonds, 18 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 8-amino-N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]decanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]-8-hydroxyoctanamide;N-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-propan-2-yloxan-3-yl]octanamide is sourced from PubChem (CID 162031246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).