2,3-dihydro-1H-indeno[1,2-c]isoquinoline

C16H13N — CID 87461110

IUPAC2,3-dihydro-1H-indeno[1,2-c]isoquinoline
SMILESC1=c2cnc3c(c2CCC1)C=c1ccccc1=3
InChIInChI=1S/C16H13N/c1-4-8-14-11(5-1)9-15-13-7-3-2-6-12(13)10-17-16(14)15/h1,4-6,8-10H,2-3,7H2
InChIKeyVBCQOBDRCLCBJZ-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.63
Rot. Bonds

About 2,3-dihydro-1H-indeno[1,2-c]isoquinoline

2,3-dihydro-1H-indeno[1,2-c]isoquinoline (PubChem CID 87461110) has the molecular formula C16H13N and a molecular weight of 219.29 g/mol. Its IUPAC name is 2,3-dihydro-1H-indeno[1,2-c]isoquinoline.

Molecular Properties

Compound Name2,3-dihydro-1H-indeno[1,2-c]isoquinoline
PubChem CID87461110
Molecular FormulaC16H13N
Molecular Weight219.29 g/mol
Exact Mass219.10
IUPAC Name2,3-dihydro-1H-indeno[1,2-c]isoquinoline
SMILESC1=c2cnc3c(c2CCC1)C=c1ccccc1=3
InChIInChI=1S/C16H13N/c1-4-8-14-11(5-1)9-15-13-7-3-2-6-12(13)10-17-16(14)15/h1,4-6,8-10H,2-3,7H2
InChIKeyVBCQOBDRCLCBJZ-UHFFFAOYSA-N
XLogP1.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indeno[1,2-c]isoquinoline?
The IUPAC name of 2,3-dihydro-1H-indeno[1,2-c]isoquinoline (CID 87461110) is 2,3-dihydro-1H-indeno[1,2-c]isoquinoline.
What is the SMILES notation for 2,3-dihydro-1H-indeno[1,2-c]isoquinoline?
The canonical SMILES for 2,3-dihydro-1H-indeno[1,2-c]isoquinoline is C1=c2cnc3c(c2CCC1)C=c1ccccc1=3.
What is the InChIKey of 2,3-dihydro-1H-indeno[1,2-c]isoquinoline?
The InChIKey is VBCQOBDRCLCBJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N/c1-4-8-14-11(5-1)9-15-13-7-3-2-6-12(13)10-17-16(14)15/h1,4-6,8-10H,2-3,7H2.
What are the key properties of 2,3-dihydro-1H-indeno[1,2-c]isoquinoline?
2,3-dihydro-1H-indeno[1,2-c]isoquinoline has a molecular weight of 219.29 g/mol, XLogP of 1.63, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indeno[1,2-c]isoquinoline is sourced from PubChem (CID 87461110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).