1-(1H-inden-1-yl)-2-propylnaphthalene

C22H20 — CID 21095753

IUPAC1-(1H-inden-1-yl)-2-propylnaphthalene
SMILESCCCc1ccc2ccccc2c1C1C=Cc2ccccc21
InChIInChI=1S/C22H20/c1-2-7-18-13-12-17-9-4-6-11-20(17)22(18)21-15-14-16-8-3-5-10-19(16)21/h3-6,8-15,21H,2,7H2,1H3
InChIKeyPRJOCHNUCAFTHV-UHFFFAOYSA-N
MW284.40 g/mol
LogP5.95
Rot. Bonds3

About 1-(1H-inden-1-yl)-2-propylnaphthalene

1-(1H-inden-1-yl)-2-propylnaphthalene (PubChem CID 21095753) has the molecular formula C22H20 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(1H-inden-1-yl)-2-propylnaphthalene.

Molecular Properties

Compound Name1-(1H-inden-1-yl)-2-propylnaphthalene
PubChem CID21095753
Molecular FormulaC22H20
Molecular Weight284.40 g/mol
Exact Mass284.16
IUPAC Name1-(1H-inden-1-yl)-2-propylnaphthalene
SMILESCCCc1ccc2ccccc2c1C1C=Cc2ccccc21
InChIInChI=1S/C22H20/c1-2-7-18-13-12-17-9-4-6-11-20(17)22(18)21-15-14-16-8-3-5-10-19(16)21/h3-6,8-15,21H,2,7H2,1H3
InChIKeyPRJOCHNUCAFTHV-UHFFFAOYSA-N
XLogP5.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.40
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-inden-1-yl)-2-propylnaphthalene?
The IUPAC name of 1-(1H-inden-1-yl)-2-propylnaphthalene (CID 21095753) is 1-(1H-inden-1-yl)-2-propylnaphthalene.
What is the SMILES notation for 1-(1H-inden-1-yl)-2-propylnaphthalene?
The canonical SMILES for 1-(1H-inden-1-yl)-2-propylnaphthalene is CCCc1ccc2ccccc2c1C1C=Cc2ccccc21.
What is the InChIKey of 1-(1H-inden-1-yl)-2-propylnaphthalene?
The InChIKey is PRJOCHNUCAFTHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20/c1-2-7-18-13-12-17-9-4-6-11-20(17)22(18)21-15-14-16-8-3-5-10-19(16)21/h3-6,8-15,21H,2,7H2,1H3.
What are the key properties of 1-(1H-inden-1-yl)-2-propylnaphthalene?
1-(1H-inden-1-yl)-2-propylnaphthalene has a molecular weight of 284.40 g/mol, XLogP of 5.95, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-inden-1-yl)-2-propylnaphthalene is sourced from PubChem (CID 21095753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).