4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]

C10H16 — CID 123735498

IUPAC4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]
SMILESCCCC1CC12C1C(C)C12
InChIInChI=1S/C10H16/c1-3-4-7-5-10(7)8-6(2)9(8)10/h6-9H,3-5H2,1-2H3
InChIKeyLXQGBXVXEGWTHP-UHFFFAOYSA-N
MW136.24 g/mol
LogP2.69
Rot. Bonds2

About 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]

4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane] (PubChem CID 123735498) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane].

Molecular Properties

Compound Name4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]
PubChem CID123735498
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]
SMILESCCCC1CC12C1C(C)C12
InChIInChI=1S/C10H16/c1-3-4-7-5-10(7)8-6(2)9(8)10/h6-9H,3-5H2,1-2H3
InChIKeyLXQGBXVXEGWTHP-UHFFFAOYSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]?
The IUPAC name of 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane] (CID 123735498) is 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane].
What is the SMILES notation for 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]?
The canonical SMILES for 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane] is CCCC1CC12C1C(C)C12.
What is the InChIKey of 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]?
The InChIKey is LXQGBXVXEGWTHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-3-4-7-5-10(7)8-6(2)9(8)10/h6-9H,3-5H2,1-2H3.
What are the key properties of 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane]?
4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane] has a molecular weight of 136.24 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2'-propylspiro[bicyclo[1.1.0]butane-2,1'-cyclopropane] is sourced from PubChem (CID 123735498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).