11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole

C23H19N — CID 142394580

IUPAC11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole
SMILESC/C=C(/C)n1c2ccccc2c2ccc3c(c21)Cc1ccccc1-3
InChIInChI=1S/C23H19N/c1-3-15(2)24-22-11-7-6-10-19(22)20-13-12-18-17-9-5-4-8-16(17)14-21(18)23(20)24/h3-13H,14H2,1-2H3/b15-3-
InChIKeyZDELVHXKKODLDO-CQPUUCJISA-N
MW309.41 g/mol
LogP6.25
Rot. Bonds1

About 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole

11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole (PubChem CID 142394580) has the molecular formula C23H19N and a molecular weight of 309.41 g/mol. Its IUPAC name is 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole.

Molecular Properties

Compound Name11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole
PubChem CID142394580
Molecular FormulaC23H19N
Molecular Weight309.41 g/mol
Exact Mass309.15
IUPAC Name11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole
SMILESC/C=C(/C)n1c2ccccc2c2ccc3c(c21)Cc1ccccc1-3
InChIInChI=1S/C23H19N/c1-3-15(2)24-22-11-7-6-10-19(22)20-13-12-18-17-9-5-4-8-16(17)14-21(18)23(20)24/h3-13H,14H2,1-2H3/b15-3-
InChIKeyZDELVHXKKODLDO-CQPUUCJISA-N
XLogP6.25
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.41
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

15-azaoctacyclo[18.11.0.02,14.05,13.06,11.015,19.021,29.023,28]hentriaconta-1(20),2(14),3,5(13),6,8,10,16,18,21(29),23,25,27,30-tetradecaene
CID 157307894
19-azaoctacyclo[18.11.0.02,14.04,12.05,10.015,19.021,29.023,28]hentriaconta-1(20),2(14),3,5,7,9,12,15,17,21(29),23,25,27,30-tetradecaene
CID 158281476
26-azanonacyclo[17.14.1.02,17.03,15.06,14.07,12.020,25.026,34.027,32]tetratriaconta-1,3(15),4,6(14),7,9,11,17,19(34),20,22,24,27,29,31-pentadecaene
CID 167571724
1-azaheptacyclo[13.10.1.02,14.03,11.04,9.019,26.020,25]hexacosa-2(14),3(11),4,6,8,12,15,17,19(26),20,22,24-dodecaene;1-azaheptacyclo[13.10.1.02,14.03,11.05,10.019,26.020,25]hexacosa-2(14),3(11),5,7,9,12,15,17,19(26),20,22,24-dodecaene;1-azaheptacyclo[13.10.1.02,14.04,12.05,10.019,26.020,25]hexacosa-2(14),3,5,7,9,12,15,17,19(26),20,22,24-dodecaene;15-azaheptacyclo[13.10.1.02,14.04,12.05,10.016,21.022,26]hexacosa-1(25),2(14),3,5,7,9,12,16,18,20,22(26),23-dodecaene
CID 158806494
1-azanonacyclo[21.10.1.02,21.04,19.06,18.09,17.010,15.027,34.028,33]tetratriaconta-2,4(19),6(18),7,9(17),10,12,14,20,23(34),24,26,28,30,32-pentadecaene
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9-propyl-9-azaheptacyclo[15.11.0.02,10.03,8.011,16.018,26.020,25]octacosa-1(17),2(10),3,5,7,11,13,15,18(26),20,22,24,27-tridecaene
CID 160884355
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenyl-2-[9-phenyl-6-(11-phenyl-12H-indeno[2,1-a]carbazol-8-yl)carbazol-3-yl]indolo[3,2-b]carbazole
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1-ethyl-9-(9H-fluoren-1-ylmethyl)carbazole
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CID 158856907
9-[(1E)-1-[1-(9H-fluoren-1-yl)-2-methylindol-3-yl]buta-1,3-dien-2-yl]carbazole
CID 166755903
11-[4-(4-isocyanophenyl)naphthalen-2-yl]-12H-indeno[2,1-a]carbazole
CID 160559545
1-azanonacyclo[21.10.1.02,21.05,20.07,19.08,16.010,15.027,34.028,33]tetratriaconta-2(21),3,5(20),7(19),8(16),10,12,14,17,23(34),24,26,28,30,32-pentadecaene;1-azanonacyclo[21.10.1.02,21.05,20.07,19.09,17.010,15.027,34.028,33]tetratriaconta-2(21),3,5(20),7,9(17),10,12,14,18,23(34),24,26,28,30,32-pentadecaene;1-azanonacyclo[21.10.1.02,21.05,20.07,19.09,17.011,16.027,34.028,33]tetratriaconta-2(21),3,5(20),7(19),8,11,13,15,17,23(34),24,26,28,30,32-pentadecaene;ethane
CID 167590703

Frequently Asked Questions

What is the IUPAC name of 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole?
The IUPAC name of 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole (CID 142394580) is 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole.
What is the SMILES notation for 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole?
The canonical SMILES for 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole is C/C=C(/C)n1c2ccccc2c2ccc3c(c21)Cc1ccccc1-3.
What is the InChIKey of 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole?
The InChIKey is ZDELVHXKKODLDO-CQPUUCJISA-N. The full InChI is InChI=1S/C23H19N/c1-3-15(2)24-22-11-7-6-10-19(22)20-13-12-18-17-9-5-4-8-16(17)14-21(18)23(20)24/h3-13H,14H2,1-2H3/b15-3-.
What are the key properties of 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole?
11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole has a molecular weight of 309.41 g/mol, XLogP of 6.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[(Z)-but-2-en-2-yl]-12H-indeno[2,1-a]carbazole is sourced from PubChem (CID 142394580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).