(5S)-1-methylbicyclo[3.2.0]heptane

C8H14 — CID 142053045

IUPAC(5S)-1-methylbicyclo[3.2.0]heptane
SMILESCC12CCC[C@H]1CC2
InChIInChI=1S/C8H14/c1-8-5-2-3-7(8)4-6-8/h7H,2-6H2,1H3/t7-,8?/m0/s1
InChIKeySZDIAXANRQLOFN-JAMMHHFISA-N
MW110.20 g/mol
LogP2.59
Rot. Bonds

About (5S)-1-methylbicyclo[3.2.0]heptane

(5S)-1-methylbicyclo[3.2.0]heptane (PubChem CID 142053045) has the molecular formula C8H14 and a molecular weight of 110.20 g/mol. Its IUPAC name is (5S)-1-methylbicyclo[3.2.0]heptane.

Molecular Properties

Compound Name(5S)-1-methylbicyclo[3.2.0]heptane
PubChem CID142053045
Molecular FormulaC8H14
Molecular Weight110.20 g/mol
Exact Mass110.11
IUPAC Name(5S)-1-methylbicyclo[3.2.0]heptane
SMILESCC12CCC[C@H]1CC2
InChIInChI=1S/C8H14/c1-8-5-2-3-7(8)4-6-8/h7H,2-6H2,1H3/t7-,8?/m0/s1
InChIKeySZDIAXANRQLOFN-JAMMHHFISA-N
XLogP2.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.20
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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5-(1,4-dimethylcyclohexyl)cyclooctan-1-amine
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4-(1-methylcyclopentyl)cyclohexan-1-ol
CID 69367175
6-cycloundecyl-6-methyldiazecane
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4-cyclohexyl-4-methyloxane
CID 58667675
3a-methyl-1,3,4,5,6,6a-hexahydrocyclopenta[c]thiophene
CID 171814964
(2R,6aS)-2-fluoro-6a-methyl-2,3,3a,4,5,6-hexahydro-1H-pentalene
CID 170095403
(3-chloro-1-methylcyclopentyl)cycloheptane
CID 116540220
(2R,4aR)-2,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene
CID 169205575
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CID 640677
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Frequently Asked Questions

What is the IUPAC name of (5S)-1-methylbicyclo[3.2.0]heptane?
The IUPAC name of (5S)-1-methylbicyclo[3.2.0]heptane (CID 142053045) is (5S)-1-methylbicyclo[3.2.0]heptane.
What is the SMILES notation for (5S)-1-methylbicyclo[3.2.0]heptane?
The canonical SMILES for (5S)-1-methylbicyclo[3.2.0]heptane is CC12CCC[C@H]1CC2.
What is the InChIKey of (5S)-1-methylbicyclo[3.2.0]heptane?
The InChIKey is SZDIAXANRQLOFN-JAMMHHFISA-N. The full InChI is InChI=1S/C8H14/c1-8-5-2-3-7(8)4-6-8/h7H,2-6H2,1H3/t7-,8?/m0/s1.
What are the key properties of (5S)-1-methylbicyclo[3.2.0]heptane?
(5S)-1-methylbicyclo[3.2.0]heptane has a molecular weight of 110.20 g/mol, XLogP of 2.59, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1-methylbicyclo[3.2.0]heptane is sourced from PubChem (CID 142053045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).