(1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene

C15H20 — CID 134857369

IUPAC(1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene
SMILESC1=C2CCCCC2=C[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]12
InChIInChI=1S/C15H20/c1-2-4-11-9-15-13-6-5-12(7-13)14(15)8-10(11)3-1/h8-9,12-15H,1-7H2/t12-,13+,14+,15-
InChIKeyZMBQAZOADZWVID-PYHGIMPFSA-N
MW200.32 g/mol
LogP4.09
Rot. Bonds

About (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene

(1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene (PubChem CID 134857369) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene.

Molecular Properties

Compound Name(1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene
PubChem CID134857369
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Name(1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene
SMILESC1=C2CCCCC2=C[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]12
InChIInChI=1S/C15H20/c1-2-4-11-9-15-13-6-5-12(7-13)14(15)8-10(11)3-1/h8-9,12-15H,1-7H2/t12-,13+,14+,15-
InChIKeyZMBQAZOADZWVID-PYHGIMPFSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene with MolForge

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Related Compounds

(1S,8R)-2,2,7,7-tetramethyltricyclo[6.2.1.01,6]undeca-3,5-diene
CID 163106170
1,2,3,4,4a,5,8,8a-Octahydro-1,4-methanonaphthalene
CID 548751
1,3,4,5-Tetrahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene
CID 583109
(1s,7s,8s,9s)-2,2,7,9-Tetramethyltricyclo[6,2,1,0 1,6]undec-5-ene
CID 21632204
Gona-4,9-diene
CID 129664828
8,9-Dehydroisolongifolene
CID 91748457
Tetracyclo[6.6.1.0(2,7).0(9,14)]pentadeca-4,11-diene
CID 556732
5-Methyl-tricyclo[6.2.1.02,7]undec-4-ene
CID 53632406
Hexahydro-1,4-methanonaphthalene
CID 129880772
(1S,11R)-tetracyclo[9.2.1.02,10.04,8]tetradeca-3,8-diene
CID 134983120
4a,6b,10a,11,11a,11b,12,12a-Octahydroindeno[2,1-a]fluorene
CID 135025142
CID 135042228
CID 135042228

Frequently Asked Questions

What is the IUPAC name of (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene?
The IUPAC name of (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene (CID 134857369) is (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene.
What is the SMILES notation for (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene?
The canonical SMILES for (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene is C1=C2CCCCC2=C[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]12.
What is the InChIKey of (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene?
The InChIKey is ZMBQAZOADZWVID-PYHGIMPFSA-N. The full InChI is InChI=1S/C15H20/c1-2-4-11-9-15-13-6-5-12(7-13)14(15)8-10(11)3-1/h8-9,12-15H,1-7H2/t12-,13+,14+,15-.
What are the key properties of (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene?
(1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene has a molecular weight of 200.32 g/mol, XLogP of 4.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,11R,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-3,9-diene is sourced from PubChem (CID 134857369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).