(10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane

C97H109F4N9O19 — CID 164987166

About (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane

(10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane (PubChem CID 164987166) has the molecular formula C97H109F4N9O19 and a molecular weight of 1780.97 g/mol. Its IUPAC name is (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane.

Molecular Properties

• Compound Name: (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane
• PubChem CID: 164987166
• Molecular Formula: C97H109F4N9O19
• Molecular Weight: 1780.97 g/mol
• Exact Mass: 1779.78
• IUPAC Name: (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane
• SMILES: C.C.C.C.CC(=O)CC1CCc2c(C)c(F)cc(N)c2C1=O.CC(=O)CC1CCc2c(C)c(F)cc(NC(C)=O)c2C1=O.CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)CCC1=O.CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2C(NC(C)=O)CC3.CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2[C@@H](N)CC3
• InChI: InChI=1S/C26H24FN3O5.C24H22FN3O4.C16H18FNO3.C14H16FNO2.C13H13NO5.4CH4/c1-4-26(34)16-7-20-23-14(9-30(20)24(32)15(16)10-35-25(26)33)22-18(28-12(3)31)6-5-13-11(2)17(27)8-19(29-23)21(13)22;1-3-24(31)14-6-18-21-12(8-28(18)22(29)13(14)9-32-23(24)30)19-16(26)5-4-11-10(2)15(25)7-17(27-21)20(11)19;1-8(19)6-11-4-5-12-9(2)13(17)7-14(18-10(3)20)15(12)16(11)21;1-7(17)5-9-3-4-10-8(2)11(15)6-12(16)13(10)14(9)18;1-2-13(18)8-5-9-10(15)3-4-14(9)11(16)7(8)6-19-12(13)17;;;;/h7-8,18,34H,4-6,9-10H2,1-3H3,(H,28,31);6-7,16,31H,3-5,8-9,26H2,1-2H3;7,11H,4-6H2,1-3H3,(H,18,20);6,9H,3-5,16H2,1-2H3;5,18H,2-4,6H2,1H3;4*1H4/t18?,26-;16-,24-;;;13-;;;;/m00..0..../s1
• InChIKey: GIEKEIJCPIBFCT-VKRRCLKESA-N
• XLogP: 13.01
• TPSA: 426.96 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 26
• Rotatable Bonds: 9
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1780.97
LogP ≤ 5	13.01
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane?

The IUPAC name of (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane (CID 164987166) is (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane.

What is the SMILES notation for (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane?

The canonical SMILES for (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane is C.C.C.C.CC(=O)CC1CCc2c(C)c(F)cc(N)c2C1=O.CC(=O)CC1CCc2c(C)c(F)cc(NC(C)=O)c2C1=O.CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)CCC1=O.CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2C(NC(C)=O)CC3.CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2[C@@H](N)CC3.

What is the InChIKey of (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane?

The InChIKey is GIEKEIJCPIBFCT-VKRRCLKESA-N. The full InChI is InChI=1S/C26H24FN3O5.C24H22FN3O4.C16H18FNO3.C14H16FNO2.C13H13NO5.4CH4/c1-4-26(34)16-7-20-23-14(9-30(20)24(32)15(16)10-35-25(26)33)22-18(28-12(3)31)6-5-13-11(2)17(27)8-19(29-23)21(13)22;1-3-24(31)14-6-18-21-12(8-28(18)22(29)13(14)9-32-23(24)30)19-16(26)5-4-11-10(2)15(25)7-17(27-21)20(11)19;1-8(19)6-11-4-5-12-9(2)13(17)7-14(18-10(3)20)15(12)16(11)21;1-7(17)5-9-3-4-10-8(2)11(15)6-12(16)13(10)14(9)18;1-2-13(18)8-5-9-10(15)3-4-14(9)11(16)7(8)6-19-12(13)17;;;;/h7-8,18,34H,4-6,9-10H2,1-3H3,(H,28,31);6-7,16,31H,3-5,8-9,26H2,1-2H3;7,11H,4-6H2,1-3H3,(H,18,20);6,9H,3-5,16H2,1-2H3;5,18H,2-4,6H2,1H3;4*1H4/t18?,26-;16-,24-;;;13-;;;;/m00..0..../s1.

What are the key properties of (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane?

(10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane has a molecular weight of 1780.97 g/mol, XLogP of 13.01, 9 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for (10S,23S)-23-amino-10-ethyl-18-fluoro-10-hydroxy-19-methyl-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaene-5,9-dione;8-amino-6-fluoro-5-methyl-2-(2-oxopropyl)-3,4-dihydro-2H-naphthalen-1-one;N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide;(4S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10-trione;N-[3-fluoro-4-methyl-8-oxo-7-(2-oxopropyl)-6,7-dihydro-5H-naphthalen-1-yl]acetamide;methane is sourced from PubChem (CID 164987166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).