1,2-dihydrobenzo[cd]indole

C11H9N — CID 14299730

IUPAC1,2-dihydrobenzo[cd]indole
SMILESc1cc2c3c(cccc3c1)NC2
InChIInChI=1S/C11H9N/c1-3-8-4-2-6-10-11(8)9(5-1)7-12-10/h1-6,12H,7H2
InChIKeyHFJHUOIVZVHBBM-UHFFFAOYSA-N
MW155.20 g/mol
LogP2.77
Rot. Bonds

About 1,2-dihydrobenzo[cd]indole

1,2-dihydrobenzo[cd]indole (PubChem CID 14299730) has the molecular formula C11H9N and a molecular weight of 155.20 g/mol. Its IUPAC name is 1,2-dihydrobenzo[cd]indole.

Molecular Properties

Compound Name1,2-dihydrobenzo[cd]indole
PubChem CID14299730
Molecular FormulaC11H9N
Molecular Weight155.20 g/mol
Exact Mass155.07
IUPAC Name1,2-dihydrobenzo[cd]indole
SMILESc1cc2c3c(cccc3c1)NC2
InChIInChI=1S/C11H9N/c1-3-8-4-2-6-10-11(8)9(5-1)7-12-10/h1-6,12H,7H2
InChIKeyHFJHUOIVZVHBBM-UHFFFAOYSA-N
XLogP2.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-Ethyl-1-naphthalenamine
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2,3-dimethyl-2,3-dihydro-1H-indole
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2-(3,5-Dimethylphenyl)isoindoline
CID 613815
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CID 137505
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CID 75530

Frequently Asked Questions

What is the IUPAC name of 1,2-dihydrobenzo[cd]indole?
The IUPAC name of 1,2-dihydrobenzo[cd]indole (CID 14299730) is 1,2-dihydrobenzo[cd]indole.
What is the SMILES notation for 1,2-dihydrobenzo[cd]indole?
The canonical SMILES for 1,2-dihydrobenzo[cd]indole is c1cc2c3c(cccc3c1)NC2.
What is the InChIKey of 1,2-dihydrobenzo[cd]indole?
The InChIKey is HFJHUOIVZVHBBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N/c1-3-8-4-2-6-10-11(8)9(5-1)7-12-10/h1-6,12H,7H2.
What are the key properties of 1,2-dihydrobenzo[cd]indole?
1,2-dihydrobenzo[cd]indole has a molecular weight of 155.20 g/mol, XLogP of 2.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydrobenzo[cd]indole is sourced from PubChem (CID 14299730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).