(3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene

C15H24 — CID 91753251

IUPAC(3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene
SMILESCC(C)=C1CC(C)(C)CC2=C1CC[C@H]2C
InChIInChI=1S/C15H24/c1-10(2)13-8-15(4,5)9-14-11(3)6-7-12(13)14/h11H,6-9H2,1-5H3/t11-/m1/s1
InChIKeyXLVUTANZHOECMR-LLVKDONJSA-N
MW204.36 g/mol
LogP4.87
Rot. Bonds

About (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene

(3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene (PubChem CID 91753251) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene.

Molecular Properties

Compound Name(3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene
PubChem CID91753251
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene
SMILESCC(C)=C1CC(C)(C)CC2=C1CC[C@H]2C
InChIInChI=1S/C15H24/c1-10(2)13-8-15(4,5)9-14-11(3)6-7-12(13)14/h11H,6-9H2,1-5H3/t11-/m1/s1
InChIKeyXLVUTANZHOECMR-LLVKDONJSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene?
The IUPAC name of (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene (CID 91753251) is (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene.
What is the SMILES notation for (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene?
The canonical SMILES for (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene is CC(C)=C1CC(C)(C)CC2=C1CC[C@H]2C.
What is the InChIKey of (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene?
The InChIKey is XLVUTANZHOECMR-LLVKDONJSA-N. The full InChI is InChI=1S/C15H24/c1-10(2)13-8-15(4,5)9-14-11(3)6-7-12(13)14/h11H,6-9H2,1-5H3/t11-/m1/s1.
What are the key properties of (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene?
(3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene has a molecular weight of 204.36 g/mol, XLogP of 4.87, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3,5,5-trimethyl-7-propan-2-ylidene-2,3,4,6-tetrahydro-1H-indene is sourced from PubChem (CID 91753251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).