2,7-dimethyl-9-(2-methylpropyl)carbazole

C18H21N — CID 130182520

IUPAC2,7-dimethyl-9-(2-methylpropyl)carbazole
SMILESCc1ccc2c3ccc(C)cc3n(CC(C)C)c2c1
InChIInChI=1S/C18H21N/c1-12(2)11-19-17-9-13(3)5-7-15(17)16-8-6-14(4)10-18(16)19/h5-10,12H,11H2,1-4H3
InChIKeyDYGMLDMDDIGUKG-UHFFFAOYSA-N
MW251.37 g/mol
LogP5.07
Rot. Bonds2

About 2,7-dimethyl-9-(2-methylpropyl)carbazole

2,7-dimethyl-9-(2-methylpropyl)carbazole (PubChem CID 130182520) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 2,7-dimethyl-9-(2-methylpropyl)carbazole.

Molecular Properties

Compound Name2,7-dimethyl-9-(2-methylpropyl)carbazole
PubChem CID130182520
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name2,7-dimethyl-9-(2-methylpropyl)carbazole
SMILESCc1ccc2c3ccc(C)cc3n(CC(C)C)c2c1
InChIInChI=1S/C18H21N/c1-12(2)11-19-17-9-13(3)5-7-15(17)16-8-6-14(4)10-18(16)19/h5-10,12H,11H2,1-4H3
InChIKeyDYGMLDMDDIGUKG-UHFFFAOYSA-N
XLogP5.07
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500251.37
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-9-(2-methylpropyl)carbazole?
The IUPAC name of 2,7-dimethyl-9-(2-methylpropyl)carbazole (CID 130182520) is 2,7-dimethyl-9-(2-methylpropyl)carbazole.
What is the SMILES notation for 2,7-dimethyl-9-(2-methylpropyl)carbazole?
The canonical SMILES for 2,7-dimethyl-9-(2-methylpropyl)carbazole is Cc1ccc2c3ccc(C)cc3n(CC(C)C)c2c1.
What is the InChIKey of 2,7-dimethyl-9-(2-methylpropyl)carbazole?
The InChIKey is DYGMLDMDDIGUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-12(2)11-19-17-9-13(3)5-7-15(17)16-8-6-14(4)10-18(16)19/h5-10,12H,11H2,1-4H3.
What are the key properties of 2,7-dimethyl-9-(2-methylpropyl)carbazole?
2,7-dimethyl-9-(2-methylpropyl)carbazole has a molecular weight of 251.37 g/mol, XLogP of 5.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-9-(2-methylpropyl)carbazole is sourced from PubChem (CID 130182520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).