2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one

C21H20N2O — CID 175227855

IUPAC2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2ccccc2N1.c1ccc2c3c(ccc2c1)CCN3
InChIInChI=1S/C12H11N.C9H9NO/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11;11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6,13H,7-8H2;1-4H,5-6H2,(H,10,11)
InChIKeyCCDQMGZRXRSTTM-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.38
Rot. Bonds

About 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one

2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one (PubChem CID 175227855) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one
PubChem CID175227855
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC Name2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2ccccc2N1.c1ccc2c3c(ccc2c1)CCN3
InChIInChI=1S/C12H11N.C9H9NO/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11;11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6,13H,7-8H2;1-4H,5-6H2,(H,10,11)
InChIKeyCCDQMGZRXRSTTM-UHFFFAOYSA-N
XLogP4.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one (CID 175227855) is 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one is O=C1CCc2ccccc2N1.c1ccc2c3c(ccc2c1)CCN3.
What is the InChIKey of 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one?
The InChIKey is CCDQMGZRXRSTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N.C9H9NO/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11;11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6,13H,7-8H2;1-4H,5-6H2,(H,10,11).
What are the key properties of 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one?
2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one has a molecular weight of 316.40 g/mol, XLogP of 4.38, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-benzo[g]indole;3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 175227855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).