11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene

C29H26N2 — CID 145449440

IUPAC11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene
SMILESCn1c2c(c3cc4c5cc6c(cc5n(C)c4cc31)C(C)(C)c1ccccc1-6)C=CCC2
InChIInChI=1S/C29H26N2/c1-29(2)23-11-7-5-9-17(23)19-13-21-22-14-20-18-10-6-8-12-25(18)30(3)27(20)16-28(22)31(4)26(21)15-24(19)29/h5-7,9-11,13-16H,8,12H2,1-4H3
InChIKeyJUAWPMXYPDSUJX-UHFFFAOYSA-N
MW402.54 g/mol
LogP7.09
Rot. Bonds

About 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene

11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene (PubChem CID 145449440) has the molecular formula C29H26N2 and a molecular weight of 402.54 g/mol. Its IUPAC name is 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene.

Molecular Properties

Compound Name11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene
PubChem CID145449440
Molecular FormulaC29H26N2
Molecular Weight402.54 g/mol
Exact Mass402.21
IUPAC Name11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene
SMILESCn1c2c(c3cc4c5cc6c(cc5n(C)c4cc31)C(C)(C)c1ccccc1-6)C=CCC2
InChIInChI=1S/C29H26N2/c1-29(2)23-11-7-5-9-17(23)19-13-21-22-14-20-18-10-6-8-12-25(18)30(3)27(20)16-28(22)31(4)26(21)15-24(19)29/h5-7,9-11,13-16H,8,12H2,1-4H3
InChIKeyJUAWPMXYPDSUJX-UHFFFAOYSA-N
XLogP7.09
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.54
LogP ≤ 57.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene with MolForge

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Related Compounds

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CID 70919345
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5-(4-fluoranthen-3-ylphenyl)-11,11-dimethyl-3,4-dihydroindeno[1,2-b]carbazole
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ethane;2,5,7,7-tetramethyl-3-(2-methylphenyl)indeno[2,1-b]carbazole
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6-[4-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-phenyl-1,2-dihydrocarbazole
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[3-(28,28-dimethyl-32-azaoctacyclo[16.14.0.03,16.04,9.010,15.019,31.021,29.022,27]dotriaconta-1,3(16),4,6,8,10(15),11,17,19,21(29),22,24,26,30-tetradecaen-32-yl)phenyl]methanamine
CID 145144739
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CID 144578730
15,25,25-trimethyl-5-selena-15-azaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(27),2(14),3,6,8,10,12,16,18(26),19,21,23-dodecaene
CID 145449768
29,29-dimethyl-11-oxa-1-azanonacyclo[17.13.1.02,14.04,12.05,10.015,33.020,32.022,30.023,28]tritriaconta-2(14),3,5,7,9,12,15,17,19(33),20,22(30),23,25,27,31-pentadecaene
CID 146375845

Frequently Asked Questions

What is the IUPAC name of 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene?
The IUPAC name of 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene (CID 145449440) is 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene.
What is the SMILES notation for 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene?
The canonical SMILES for 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene is Cn1c2c(c3cc4c5cc6c(cc5n(C)c4cc31)C(C)(C)c1ccccc1-6)C=CCC2.
What is the InChIKey of 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene?
The InChIKey is JUAWPMXYPDSUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2/c1-29(2)23-11-7-5-9-17(23)19-13-21-22-14-20-18-10-6-8-12-25(18)30(3)27(20)16-28(22)31(4)26(21)15-24(19)29/h5-7,9-11,13-16H,8,12H2,1-4H3.
What are the key properties of 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene?
11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene has a molecular weight of 402.54 g/mol, XLogP of 7.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11,15,19,19-tetramethyl-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,13,16,18(26),20,22,24-undecaene is sourced from PubChem (CID 145449440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).