benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide

C119H174N10O34 — CID 161174245

About benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide

benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide (PubChem CID 161174245) has the molecular formula C119H174N10O34 and a molecular weight of 2288.74 g/mol. Its IUPAC name is benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide.

Molecular Properties

• Compound Name: benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide
• PubChem CID: 161174245
• Molecular Formula: C119H174N10O34
• Molecular Weight: 2288.74 g/mol
• Exact Mass: 2287.22
• IUPAC Name: benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide
• SMILES: CC(C)C[C@H](NC(=O)c1ccc2ccccc2c1)C(=O)N[C@@H]1C(=O)COC[C@@H]1C.COC1(OC)COCC(C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C.COC1(OC)COC[C@H](C)[C@@H]1N.COC1(OC)COC[C@H](C)[C@@H]1NC(=O)OCc1ccccc1.COC1(OC)COC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)c1ccc2ccccc2c1.COC1(OC)COC[C@H](O)[C@@H]1NC(=O)OCc1ccccc1.O=C(N[C@@H]1C(=O)COC[C@@H]1O)OCc1ccccc1
• InChI: InChI=1S/C25H34N2O5.C23H28N2O4.C19H36N2O6.C16H23NO5.C15H21NO6.C13H15NO5.C8H17NO3/c1-16(2)12-21(24(29)27-22-17(3)14-32-15-25(22,30-4)31-5)26-23(28)20-11-10-18-8-6-7-9-19(18)13-20;1-14(2)10-19(23(28)25-21-15(3)12-29-13-20(21)26)24-22(27)18-9-8-16-6-4-5-7-17(16)11-18;1-12(2)9-14(20-17(23)27-18(4,5)6)16(22)21-15-13(3)10-26-11-19(15,24-7)25-8;1-12-9-21-11-16(19-2,20-3)14(12)17-15(18)22-10-13-7-5-4-6-8-13;1-19-15(20-2)10-21-9-12(17)13(15)16-14(18)22-8-11-6-4-3-5-7-11;15-10-7-18-8-11(16)12(10)14-13(17)19-6-9-4-2-1-3-5-9;1-6-4-12-5-8(10-2,11-3)7(6)9/h6-11,13,16-17,21-22H,12,14-15H2,1-5H3,(H,26,28)(H,27,29);4-9,11,14-15,19,21H,10,12-13H2,1-3H3,(H,24,27)(H,25,28);12-15H,9-11H2,1-8H3,(H,20,23)(H,21,22);4-8,12,14H,9-11H2,1-3H3,(H,17,18);3-7,12-13,17H,8-10H2,1-2H3,(H,16,18);1-5,10,12,15H,6-8H2,(H,14,17);6-7H,4-5,9H2,1-3H3/t17-,21-,22-;15-,19-,21-;13?,14-,15-;12-,14-;12-,13-;10-,12-;6-,7-/m0000000/s1
• InChIKey: URPADJHKONJANU-KTLLZGBISA-N
• XLogP: 10.70
• TPSA: 556.35 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 35
• Rotatable Bonds: 36
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2288.74
LogP ≤ 5	10.70
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide?

The IUPAC name of benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide (CID 161174245) is benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide.

What is the SMILES notation for benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide?

The canonical SMILES for benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide is CC(C)C[C@H](NC(=O)c1ccc2ccccc2c1)C(=O)N[C@@H]1C(=O)COC[C@@H]1C.COC1(OC)COCC(C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C.COC1(OC)COC[C@H](C)[C@@H]1N.COC1(OC)COC[C@H](C)[C@@H]1NC(=O)OCc1ccccc1.COC1(OC)COC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)c1ccc2ccccc2c1.COC1(OC)COC[C@H](O)[C@@H]1NC(=O)OCc1ccccc1.O=C(N[C@@H]1C(=O)COC[C@@H]1O)OCc1ccccc1.

What is the InChIKey of benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide?

The InChIKey is URPADJHKONJANU-KTLLZGBISA-N. The full InChI is InChI=1S/C25H34N2O5.C23H28N2O4.C19H36N2O6.C16H23NO5.C15H21NO6.C13H15NO5.C8H17NO3/c1-16(2)12-21(24(29)27-22-17(3)14-32-15-25(22,30-4)31-5)26-23(28)20-11-10-18-8-6-7-9-19(18)13-20;1-14(2)10-19(23(28)25-21-15(3)12-29-13-20(21)26)24-22(27)18-9-8-16-6-4-5-7-17(16)11-18;1-12(2)9-14(20-17(23)27-18(4,5)6)16(22)21-15-13(3)10-26-11-19(15,24-7)25-8;1-12-9-21-11-16(19-2,20-3)14(12)17-15(18)22-10-13-7-5-4-6-8-13;1-19-15(20-2)10-21-9-12(17)13(15)16-14(18)22-8-11-6-4-3-5-7-11;15-10-7-18-8-11(16)12(10)14-13(17)19-6-9-4-2-1-3-5-9;1-6-4-12-5-8(10-2,11-3)7(6)9/h6-11,13,16-17,21-22H,12,14-15H2,1-5H3,(H,26,28)(H,27,29);4-9,11,14-15,19,21H,10,12-13H2,1-3H3,(H,24,27)(H,25,28);12-15H,9-11H2,1-8H3,(H,20,23)(H,21,22);4-8,12,14H,9-11H2,1-3H3,(H,17,18);3-7,12-13,17H,8-10H2,1-2H3,(H,16,18);1-5,10,12,15H,6-8H2,(H,14,17);6-7H,4-5,9H2,1-3H3/t17-,21-,22-;15-,19-,21-;13?,14-,15-;12-,14-;12-,13-;10-,12-;6-,7-/m0000000/s1.

What are the key properties of benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide?

benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide has a molecular weight of 2288.74 g/mol, XLogP of 10.70, 36 rotatable bonds, 12 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for benzyl N-[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]carbamate;benzyl N-[(4S,5R)-5-hydroxy-3,3-dimethoxyoxan-4-yl]carbamate;benzyl N-[(3R,4S)-3-hydroxy-5-oxooxan-4-yl]carbamate;tert-butyl N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate;(4S,5R)-3,3-dimethoxy-5-methyloxan-4-amine;N-[(2S)-1-[[(4S,5R)-3,3-dimethoxy-5-methyloxan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide;N-[(2S)-4-methyl-1-[[(3R,4S)-3-methyl-5-oxooxan-4-yl]amino]-1-oxopentan-2-yl]naphthalene-2-carboxamide is sourced from PubChem (CID 161174245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).