9-methyl-8a,9a-dihydrocarbazole

C13H13N — CID 121338970

IUPAC9-methyl-8a,9a-dihydrocarbazole
SMILESCN1C2C=CC=CC2=C2C=CC=CC21
InChIInChI=1S/C13H13N/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9,12-13H,1H3
InChIKeyWAYJQTIWSPZHGM-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.22
Rot. Bonds

About 9-methyl-8a,9a-dihydrocarbazole

9-methyl-8a,9a-dihydrocarbazole (PubChem CID 121338970) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is 9-methyl-8a,9a-dihydrocarbazole.

Molecular Properties

Compound Name9-methyl-8a,9a-dihydrocarbazole
PubChem CID121338970
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name9-methyl-8a,9a-dihydrocarbazole
SMILESCN1C2C=CC=CC2=C2C=CC=CC21
InChIInChI=1S/C13H13N/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9,12-13H,1H3
InChIKeyWAYJQTIWSPZHGM-UHFFFAOYSA-N
XLogP2.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-8a,9a-dihydrocarbazole?
The IUPAC name of 9-methyl-8a,9a-dihydrocarbazole (CID 121338970) is 9-methyl-8a,9a-dihydrocarbazole.
What is the SMILES notation for 9-methyl-8a,9a-dihydrocarbazole?
The canonical SMILES for 9-methyl-8a,9a-dihydrocarbazole is CN1C2C=CC=CC2=C2C=CC=CC21.
What is the InChIKey of 9-methyl-8a,9a-dihydrocarbazole?
The InChIKey is WAYJQTIWSPZHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9,12-13H,1H3.
What are the key properties of 9-methyl-8a,9a-dihydrocarbazole?
9-methyl-8a,9a-dihydrocarbazole has a molecular weight of 183.25 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-8a,9a-dihydrocarbazole is sourced from PubChem (CID 121338970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).