2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene

C19H18 — CID 140796680

IUPAC2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene
SMILESC1=CC2CC(c3ccc4ccccc4c3)CC2C=C1
InChIInChI=1S/C19H18/c1-2-6-15-11-18(10-9-14(15)5-1)19-12-16-7-3-4-8-17(16)13-19/h1-11,16-17,19H,12-13H2
InChIKeyUAPXDYPYLKYMSI-UHFFFAOYSA-N
MW246.35 g/mol
LogP5.08
Rot. Bonds1

About 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene

2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene (PubChem CID 140796680) has the molecular formula C19H18 and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene.

Molecular Properties

Compound Name2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene
PubChem CID140796680
Molecular FormulaC19H18
Molecular Weight246.35 g/mol
Exact Mass246.14
IUPAC Name2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene
SMILESC1=CC2CC(c3ccc4ccccc4c3)CC2C=C1
InChIInChI=1S/C19H18/c1-2-6-15-11-18(10-9-14(15)5-1)19-12-16-7-3-4-8-17(16)13-19/h1-11,16-17,19H,12-13H2
InChIKeyUAPXDYPYLKYMSI-UHFFFAOYSA-N
XLogP5.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.35
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 116962282
2-cyclopropylanthracene
CID 91468721
trans-(1R,2S)-2-naphthalen-2-ylcyclopropan-1-amine
CID 51888201
trans-(2S,4S)-2-methyl-4-naphthalen-2-ylcyclopentan-1-one
CID 1239839
2-methyl-4-naphthalen-2-ylcyclopentan-1-one
CID 5080910
3-methyl-5-naphthalen-2-ylpiperidine
CID 115375238
N-methyl-4-naphthalen-2-ylcyclohexan-1-amine
CID 116962734
1,8-bis(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene
CID 140819186
2-[(1S,5R,6S,7R)-7-naphthalen-2-yl-6-bicyclo[3.2.0]heptanyl]naphthalene
CID 101353270
(1S,2S,2aR,10bR)-1,2-dinaphthalen-2-yl-1,2,2a,10b-tetrahydrocyclobuta[l]phenanthrene
CID 11944764
2-(3-naphthalen-2-yl-8-azabicyclo[3.2.1]octan-8-yl)ethanamine
CID 59042142

Frequently Asked Questions

What is the IUPAC name of 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene?
The IUPAC name of 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene (CID 140796680) is 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene.
What is the SMILES notation for 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene?
The canonical SMILES for 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene is C1=CC2CC(c3ccc4ccccc4c3)CC2C=C1.
What is the InChIKey of 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene?
The InChIKey is UAPXDYPYLKYMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18/c1-2-6-15-11-18(10-9-14(15)5-1)19-12-16-7-3-4-8-17(16)13-19/h1-11,16-17,19H,12-13H2.
What are the key properties of 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene?
2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene has a molecular weight of 246.35 g/mol, XLogP of 5.08, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,3a,7a-tetrahydro-1H-inden-2-yl)naphthalene is sourced from PubChem (CID 140796680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).