(1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene

C24H26 — CID 100983352

IUPAC(1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene
SMILESCc1ccc(C)c2c1C=C[C@H]2CC[C@@H]1C=Cc2c(C)ccc(C)c21
InChIInChI=1S/C24H26/c1-15-5-7-17(3)23-19(11-13-21(15)23)9-10-20-12-14-22-16(2)6-8-18(4)24(20)22/h5-8,11-14,19-20H,9-10H2,1-4H3/t19-,20-/m1/s1
InChIKeyGCZYAOLYVIHWLC-WOJBJXKFSA-N
MW314.47 g/mol
LogP6.62
Rot. Bonds3

About (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene

(1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene (PubChem CID 100983352) has the molecular formula C24H26 and a molecular weight of 314.47 g/mol. Its IUPAC name is (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene.

Molecular Properties

Compound Name(1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene
PubChem CID100983352
Molecular FormulaC24H26
Molecular Weight314.47 g/mol
Exact Mass314.20
IUPAC Name(1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene
SMILESCc1ccc(C)c2c1C=C[C@H]2CC[C@@H]1C=Cc2c(C)ccc(C)c21
InChIInChI=1S/C24H26/c1-15-5-7-17(3)23-19(11-13-21(15)23)9-10-20-12-14-22-16(2)6-8-18(4)24(20)22/h5-8,11-14,19-20H,9-10H2,1-4H3/t19-,20-/m1/s1
InChIKeyGCZYAOLYVIHWLC-WOJBJXKFSA-N
XLogP6.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.47
LogP ≤ 56.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene?
The IUPAC name of (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene (CID 100983352) is (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene.
What is the SMILES notation for (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene?
The canonical SMILES for (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene is Cc1ccc(C)c2c1C=C[C@H]2CC[C@@H]1C=Cc2c(C)ccc(C)c21.
What is the InChIKey of (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene?
The InChIKey is GCZYAOLYVIHWLC-WOJBJXKFSA-N. The full InChI is InChI=1S/C24H26/c1-15-5-7-17(3)23-19(11-13-21(15)23)9-10-20-12-14-22-16(2)6-8-18(4)24(20)22/h5-8,11-14,19-20H,9-10H2,1-4H3/t19-,20-/m1/s1.
What are the key properties of (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene?
(1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene has a molecular weight of 314.47 g/mol, XLogP of 6.62, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-[(1R)-4,7-dimethyl-1H-inden-1-yl]ethyl]-4,7-dimethyl-1H-indene is sourced from PubChem (CID 100983352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).