3,4,4-trimethylcarbazole

C15H15N — CID 22250977

IUPAC3,4,4-trimethylcarbazole
SMILESCC1=CC=C2N=c3ccccc3=C2C1(C)C
InChIInChI=1S/C15H15N/c1-10-8-9-13-14(15(10,2)3)11-6-4-5-7-12(11)16-13/h4-9H,1-3H3
InChIKeyNJUAZXRLYGBUIW-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.34
Rot. Bonds

About 3,4,4-trimethylcarbazole

3,4,4-trimethylcarbazole (PubChem CID 22250977) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is 3,4,4-trimethylcarbazole.

Molecular Properties

Compound Name3,4,4-trimethylcarbazole
PubChem CID22250977
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC Name3,4,4-trimethylcarbazole
SMILESCC1=CC=C2N=c3ccccc3=C2C1(C)C
InChIInChI=1S/C15H15N/c1-10-8-9-13-14(15(10,2)3)11-6-4-5-7-12(11)16-13/h4-9H,1-3H3
InChIKeyNJUAZXRLYGBUIW-UHFFFAOYSA-N
XLogP2.34
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,4,4-trimethylcarbazole?
The IUPAC name of 3,4,4-trimethylcarbazole (CID 22250977) is 3,4,4-trimethylcarbazole.
What is the SMILES notation for 3,4,4-trimethylcarbazole?
The canonical SMILES for 3,4,4-trimethylcarbazole is CC1=CC=C2N=c3ccccc3=C2C1(C)C.
What is the InChIKey of 3,4,4-trimethylcarbazole?
The InChIKey is NJUAZXRLYGBUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N/c1-10-8-9-13-14(15(10,2)3)11-6-4-5-7-12(11)16-13/h4-9H,1-3H3.
What are the key properties of 3,4,4-trimethylcarbazole?
3,4,4-trimethylcarbazole has a molecular weight of 209.29 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,4-trimethylcarbazole is sourced from PubChem (CID 22250977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).