5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]

C14H17N — CID 22953154

IUPAC5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]
SMILESC=C1Nc2ccc(C)cc2C12CCCC2
InChIInChI=1S/C14H17N/c1-10-5-6-13-12(9-10)14(11(2)15-13)7-3-4-8-14/h5-6,9,15H,2-4,7-8H2,1H3
InChIKeySBODHCGYSCQIDA-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.75
Rot. Bonds

About 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]

5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane] (PubChem CID 22953154) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane].

Molecular Properties

Compound Name5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]
PubChem CID22953154
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]
SMILESC=C1Nc2ccc(C)cc2C12CCCC2
InChIInChI=1S/C14H17N/c1-10-5-6-13-12(9-10)14(11(2)15-13)7-3-4-8-14/h5-6,9,15H,2-4,7-8H2,1H3
InChIKeySBODHCGYSCQIDA-UHFFFAOYSA-N
XLogP3.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]?
The IUPAC name of 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane] (CID 22953154) is 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane].
What is the SMILES notation for 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]?
The canonical SMILES for 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane] is C=C1Nc2ccc(C)cc2C12CCCC2.
What is the InChIKey of 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]?
The InChIKey is SBODHCGYSCQIDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N/c1-10-5-6-13-12(9-10)14(11(2)15-13)7-3-4-8-14/h5-6,9,15H,2-4,7-8H2,1H3.
What are the key properties of 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane]?
5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane] has a molecular weight of 199.30 g/mol, XLogP of 3.75, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-methylidenespiro[1H-indole-3,1'-cyclopentane] is sourced from PubChem (CID 22953154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).