5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole

C17H16N2 — CID 57494722

IUPAC5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole
SMILESCc1c2c(c(C)c3c1[nH]c1ccccc13)C=NCC2
InChIInChI=1S/C17H16N2/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17/h3-6,9,19H,7-8H2,1-2H3
InChIKeyCKERKSAMDZOBHU-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.91
Rot. Bonds

About 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole

5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole (PubChem CID 57494722) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole.

Molecular Properties

Compound Name5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole
PubChem CID57494722
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC Name5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole
SMILESCc1c2c(c(C)c3c1[nH]c1ccccc13)C=NCC2
InChIInChI=1S/C17H16N2/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17/h3-6,9,19H,7-8H2,1-2H3
InChIKeyCKERKSAMDZOBHU-UHFFFAOYSA-N
XLogP3.91
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole?
The IUPAC name of 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole (CID 57494722) is 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole.
What is the SMILES notation for 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole?
The canonical SMILES for 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole is Cc1c2c(c(C)c3c1[nH]c1ccccc13)C=NCC2.
What is the InChIKey of 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole?
The InChIKey is CKERKSAMDZOBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17/h3-6,9,19H,7-8H2,1-2H3.
What are the key properties of 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole?
5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole has a molecular weight of 248.33 g/mol, XLogP of 3.91, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,11-dimethyl-4,6-dihydro-3H-pyrido[4,3-b]carbazole is sourced from PubChem (CID 57494722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).