tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene

C10H10 — CID 123782041

IUPACtetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene
SMILESC1=CC2=C1C1CC23CCC13
InChIInChI=1S/C10H10/c1-2-8-6(1)7-5-10(8)4-3-9(7)10/h1-2,7,9H,3-5H2
InChIKeyNTPGATBIRXDRGO-UHFFFAOYSA-N
MW130.19 g/mol
LogP2.28
Rot. Bonds

About tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene

tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene (PubChem CID 123782041) has the molecular formula C10H10 and a molecular weight of 130.19 g/mol. Its IUPAC name is tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene.

Molecular Properties

Compound Nametetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene
PubChem CID123782041
Molecular FormulaC10H10
Molecular Weight130.19 g/mol
Exact Mass130.08
IUPAC Nametetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene
SMILESC1=CC2=C1C1CC23CCC13
InChIInChI=1S/C10H10/c1-2-8-6(1)7-5-10(8)4-3-9(7)10/h1-2,7,9H,3-5H2
InChIKeyNTPGATBIRXDRGO-UHFFFAOYSA-N
XLogP2.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 91253320
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CID 163586760
1-methyl-4-(4-methyl-2-bicyclo[2.2.0]hexanyl)-3,6-dihydro-2H-pyridine
CID 154968951
4,4,8-trimethyltricyclo[6.3.1.02,5]dodec-1(11)-en-10-ol
CID 14286031
(1S,3S,6R)-6-(5-fluoropyrimidin-2-yl)bicyclo[4.1.0]heptan-3-ol
CID 175911523
(1S,2S,7S,8R)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-4-en-3-one
CID 21124009
1-bicyclo[2.2.1]hept-2-enyl(trimethyl)silane
CID 66700380
(1R,4R,7Z,10S)-4,12,12-trimethyl-5-oxatricyclo[8.2.0.04,6]dodec-7-en-9-one
CID 101170815
(3aS,6aR)-5,6-dimethylspiro[2,3,3a,6a-tetrahydro-1H-pentalene-4,1'-cyclopentane]
CID 11008731
(1S,2S,5R,7S)-1,5-dimethyltricyclo[3.3.0.02,7]octan-6-one
CID 98043952
[5-[(1S,4R,5R)-4-methyl-1-bicyclo[3.1.0]hexanyl]-1,3-thiazol-2-yl]methanamine
CID 70998339
1-(cyclohexen-1-yl)-3-propylbicyclo[2.2.0]hexane
CID 163848568

Frequently Asked Questions

What is the IUPAC name of tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene?
The IUPAC name of tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene (CID 123782041) is tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene.
What is the SMILES notation for tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene?
The canonical SMILES for tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene is C1=CC2=C1C1CC23CCC13.
What is the InChIKey of tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene?
The InChIKey is NTPGATBIRXDRGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10/c1-2-8-6(1)7-5-10(8)4-3-9(7)10/h1-2,7,9H,3-5H2.
What are the key properties of tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene?
tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene has a molecular weight of 130.19 g/mol, XLogP of 2.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracyclo[4.3.1.01,7.02,5]deca-2(5),3-diene is sourced from PubChem (CID 123782041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).