(1R)-tetracyclo[4.2.0.01,7.03,5]octane

C8H10 — CID 148765284

IUPAC(1R)-tetracyclo[4.2.0.01,7.03,5]octane
SMILESC1C2C[C@]34CC3C4C12
InChIInChI=1S/C8H10/c1-4-2-8-3-6(8)7(8)5(1)4/h4-7H,1-3H2/t4?,5?,6?,7?,8-/m0/s1
InChIKeyOHILMRJBPBASPL-WNBHMGEASA-N
MW106.17 g/mol
LogP1.66
Rot. Bonds

About (1R)-tetracyclo[4.2.0.01,7.03,5]octane

(1R)-tetracyclo[4.2.0.01,7.03,5]octane (PubChem CID 148765284) has the molecular formula C8H10 and a molecular weight of 106.17 g/mol. Its IUPAC name is (1R)-tetracyclo[4.2.0.01,7.03,5]octane.

Molecular Properties

Compound Name(1R)-tetracyclo[4.2.0.01,7.03,5]octane
PubChem CID148765284
Molecular FormulaC8H10
Molecular Weight106.17 g/mol
Exact Mass106.08
IUPAC Name(1R)-tetracyclo[4.2.0.01,7.03,5]octane
SMILESC1C2C[C@]34CC3C4C12
InChIInChI=1S/C8H10/c1-4-2-8-3-6(8)7(8)5(1)4/h4-7H,1-3H2/t4?,5?,6?,7?,8-/m0/s1
InChIKeyOHILMRJBPBASPL-WNBHMGEASA-N
XLogP1.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.17
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(8S,9R,10R,12R)-tetracyclo[6.5.0.01,9.010,12]tridecane
CID 102285377
2'-(2,3-dimethylcyclohexyl)spiro[bicyclo[2.1.0]pentane-2,3'-bicyclo[3.1.0]hexane]
CID 123849579
pentacyclo[9.1.0.01,3.04,6.07,9]dodecane
CID 15781414
heptacyclo[7.5.1.01,7.02,14.03,13.05,11.06,9]pentadecane
CID 90702392
6-methyltricyclo[2.2.1.01,3]heptane
CID 123381875
heptacyclo[10.3.1.01,11.02,10.03,9.04,8.06,14]hexadecane
CID 123959771
2-ethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]
CID 163933579
9-methylhexacyclo[6.4.1.13,6.01,11.02,7.08,10]tetradecane
CID 91101429
pentacyclo[5.4.1.01,3.05,9.08,11]dodecane
CID 139773334
9,9-dimethyltricyclo[6.2.1.02,7]undecane;ethane
CID 91591704
13-methylheptacyclo[6.6.1.11,5.02,8.03,13.06,12.010,15]hexadecane
CID 91398763
(1R,2R,6S,7R,8S)-8-aminotricyclo[5.2.1.02,6]decane-8-carboxylic acid
CID 98107604

Frequently Asked Questions

What is the IUPAC name of (1R)-tetracyclo[4.2.0.01,7.03,5]octane?
The IUPAC name of (1R)-tetracyclo[4.2.0.01,7.03,5]octane (CID 148765284) is (1R)-tetracyclo[4.2.0.01,7.03,5]octane.
What is the SMILES notation for (1R)-tetracyclo[4.2.0.01,7.03,5]octane?
The canonical SMILES for (1R)-tetracyclo[4.2.0.01,7.03,5]octane is C1C2C[C@]34CC3C4C12.
What is the InChIKey of (1R)-tetracyclo[4.2.0.01,7.03,5]octane?
The InChIKey is OHILMRJBPBASPL-WNBHMGEASA-N. The full InChI is InChI=1S/C8H10/c1-4-2-8-3-6(8)7(8)5(1)4/h4-7H,1-3H2/t4?,5?,6?,7?,8-/m0/s1.
What are the key properties of (1R)-tetracyclo[4.2.0.01,7.03,5]octane?
(1R)-tetracyclo[4.2.0.01,7.03,5]octane has a molecular weight of 106.17 g/mol, XLogP of 1.66, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-tetracyclo[4.2.0.01,7.03,5]octane is sourced from PubChem (CID 148765284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).