5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole

C29H25N — CID 90180519

IUPAC5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole
SMILESCC(C)(C)n1c2ccccc2c2c3c(ccc21)-c1cccc(-c2ccccc2)c1C3
InChIInChI=1S/C29H25N/c1-29(2,3)30-26-15-8-7-12-23(26)28-25-18-24-20(19-10-5-4-6-11-19)13-9-14-21(24)22(25)16-17-27(28)30/h4-17H,18H2,1-3H3
InChIKeyNGUZGRJGHQFMRG-UHFFFAOYSA-N
MW387.53 g/mol
LogP7.79
Rot. Bonds1

About 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole

5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole (PubChem CID 90180519) has the molecular formula C29H25N and a molecular weight of 387.53 g/mol. Its IUPAC name is 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole.

Molecular Properties

Compound Name5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole
PubChem CID90180519
Molecular FormulaC29H25N
Molecular Weight387.53 g/mol
Exact Mass387.20
IUPAC Name5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole
SMILESCC(C)(C)n1c2ccccc2c2c3c(ccc21)-c1cccc(-c2ccccc2)c1C3
InChIInChI=1S/C29H25N/c1-29(2,3)30-26-15-8-7-12-23(26)28-25-18-24-20(19-10-5-4-6-11-19)13-9-14-21(24)22(25)16-17-27(28)30/h4-17H,18H2,1-3H3
InChIKeyNGUZGRJGHQFMRG-UHFFFAOYSA-N
XLogP7.79
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.53
LogP ≤ 57.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[4-(8-phenyl-9H-fluoren-1-yl)phenyl]-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134488216
9-(8-phenyl-9H-fluoren-1-yl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134488126
9-(9,9-dimethylfluoren-2-yl)-14-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134488168
9-phenyl-14-[3-[8-(3-phenylphenyl)-9H-fluoren-1-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134488188
9-tert-butyl-3-carbazol-9-ylcarbazole;9-tert-butyl-1,8-diphenylcarbazole
CID 163621897
9-tert-butyl-3-carbazol-9-ylcarbazole;9-tert-butyl-1,8-diphenylcarbazole;9-tert-butyl-1-phenylcarbazole
CID 167590629
9-tert-butyl-3-carbazol-9-ylcarbazole;9-tert-butyl-1,8-diphenylcarbazole;9-tert-butyl-1-phenylcarbazole;methane
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7-tert-butyl-4-(11-tert-butylbenzo[a]carbazol-8-yl)benzo[c]carbazole
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4-phenylcarbazol-9-amine
CID 146177430
7-[4-(9H-fluoren-1-yl)phenyl]-2,5-diphenylindolo[2,3-b]carbazole
CID 126580464
18-(3-triphenylen-2-ylphenyl)hexacyclo[12.11.0.02,7.08,13.015,23.017,22]pentacosa-1(14),2,4,6,8,10,12,15(23),17,19,21,24-dodecaene
CID 58489376
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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole?
The IUPAC name of 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole (CID 90180519) is 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole.
What is the SMILES notation for 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole?
The canonical SMILES for 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole is CC(C)(C)n1c2ccccc2c2c3c(ccc21)-c1cccc(-c2ccccc2)c1C3.
What is the InChIKey of 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole?
The InChIKey is NGUZGRJGHQFMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H25N/c1-29(2,3)30-26-15-8-7-12-23(26)28-25-18-24-20(19-10-5-4-6-11-19)13-9-14-21(24)22(25)16-17-27(28)30/h4-17H,18H2,1-3H3.
What are the key properties of 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole?
5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole has a molecular weight of 387.53 g/mol, XLogP of 7.79, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-11-phenyl-12H-indeno[1,2-c]carbazole is sourced from PubChem (CID 90180519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).