6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole

C27H22N2 — CID 58059189

IUPAC6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole
SMILESCc1cc2c(c3c4ccccc4n(-c4ccccn4)c13)C(C)(C)c1ccccc1-2
InChIInChI=1S/C27H22N2/c1-17-16-20-18-10-4-6-12-21(18)27(2,3)25(20)24-19-11-5-7-13-22(19)29(26(17)24)23-14-8-9-15-28-23/h4-16H,1-3H3
InChIKeyGVUBGPDGGOXMJX-UHFFFAOYSA-N
MW374.49 g/mol
LogP6.79
Rot. Bonds1

About 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole

6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole (PubChem CID 58059189) has the molecular formula C27H22N2 and a molecular weight of 374.49 g/mol. Its IUPAC name is 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole.

Molecular Properties

Compound Name6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole
PubChem CID58059189
Molecular FormulaC27H22N2
Molecular Weight374.49 g/mol
Exact Mass374.18
IUPAC Name6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole
SMILESCc1cc2c(c3c4ccccc4n(-c4ccccn4)c13)C(C)(C)c1ccccc1-2
InChIInChI=1S/C27H22N2/c1-17-16-20-18-10-4-6-12-21(18)27(2,3)25(20)24-19-11-5-7-13-22(19)29(26(17)24)23-14-8-9-15-28-23/h4-16H,1-3H3
InChIKeyGVUBGPDGGOXMJX-UHFFFAOYSA-N
XLogP6.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.49
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole?
The IUPAC name of 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole (CID 58059189) is 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole.
What is the SMILES notation for 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole?
The canonical SMILES for 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole is Cc1cc2c(c3c4ccccc4n(-c4ccccn4)c13)C(C)(C)c1ccccc1-2.
What is the InChIKey of 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole?
The InChIKey is GVUBGPDGGOXMJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22N2/c1-17-16-20-18-10-4-6-12-21(18)27(2,3)25(20)24-19-11-5-7-13-22(19)29(26(17)24)23-14-8-9-15-28-23/h4-16H,1-3H3.
What are the key properties of 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole?
6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole has a molecular weight of 374.49 g/mol, XLogP of 6.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,12,12-trimethyl-5-pyridin-2-ylindeno[1,2-c]carbazole is sourced from PubChem (CID 58059189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).