9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole

C16H19N — CID 142206508

IUPAC9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole
SMILESCCn1c2c(c3cc(C)ccc31)C(C)CC=C2
InChIInChI=1S/C16H19N/c1-4-17-14-9-8-11(2)10-13(14)16-12(3)6-5-7-15(16)17/h5,7-10,12H,4,6H2,1-3H3
InChIKeySSWBASICKLKELX-UHFFFAOYSA-N
MW225.33 g/mol
LogP4.49
Rot. Bonds1

About 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole

9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole (PubChem CID 142206508) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole.

Molecular Properties

Compound Name9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole
PubChem CID142206508
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole
SMILESCCn1c2c(c3cc(C)ccc31)C(C)CC=C2
InChIInChI=1S/C16H19N/c1-4-17-14-9-8-11(2)10-13(14)16-12(3)6-5-7-15(16)17/h5,7-10,12H,4,6H2,1-3H3
InChIKeySSWBASICKLKELX-UHFFFAOYSA-N
XLogP4.49
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole?
The IUPAC name of 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole (CID 142206508) is 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole.
What is the SMILES notation for 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole?
The canonical SMILES for 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole is CCn1c2c(c3cc(C)ccc31)C(C)CC=C2.
What is the InChIKey of 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole?
The InChIKey is SSWBASICKLKELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-4-17-14-9-8-11(2)10-13(14)16-12(3)6-5-7-15(16)17/h5,7-10,12H,4,6H2,1-3H3.
What are the key properties of 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole?
9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole has a molecular weight of 225.33 g/mol, XLogP of 4.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-4,6-dimethyl-3,4-dihydrocarbazole is sourced from PubChem (CID 142206508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).