2-cyclopropylspiro[2.2]pentane

C8H12 — CID 12503095

IUPAC2-cyclopropylspiro[2.2]pentane
SMILESC1CC1C1CC12CC2
InChIInChI=1S/C8H12/c1-2-6(1)7-5-8(7)3-4-8/h6-7H,1-5H2
InChIKeyNDYQCGFTTCXBQP-UHFFFAOYSA-N
MW108.18 g/mol
LogP2.20
Rot. Bonds1

About 2-cyclopropylspiro[2.2]pentane

2-cyclopropylspiro[2.2]pentane (PubChem CID 12503095) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is 2-cyclopropylspiro[2.2]pentane.

Molecular Properties

Compound Name2-cyclopropylspiro[2.2]pentane
PubChem CID12503095
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Name2-cyclopropylspiro[2.2]pentane
SMILESC1CC1C1CC12CC2
InChIInChI=1S/C8H12/c1-2-6(1)7-5-8(7)3-4-8/h6-7H,1-5H2
InChIKeyNDYQCGFTTCXBQP-UHFFFAOYSA-N
XLogP2.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylspiro[2.2]pentane?
The IUPAC name of 2-cyclopropylspiro[2.2]pentane (CID 12503095) is 2-cyclopropylspiro[2.2]pentane.
What is the SMILES notation for 2-cyclopropylspiro[2.2]pentane?
The canonical SMILES for 2-cyclopropylspiro[2.2]pentane is C1CC1C1CC12CC2.
What is the InChIKey of 2-cyclopropylspiro[2.2]pentane?
The InChIKey is NDYQCGFTTCXBQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12/c1-2-6(1)7-5-8(7)3-4-8/h6-7H,1-5H2.
What are the key properties of 2-cyclopropylspiro[2.2]pentane?
2-cyclopropylspiro[2.2]pentane has a molecular weight of 108.18 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylspiro[2.2]pentane is sourced from PubChem (CID 12503095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).