N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide

C17H23NO — CID 3850125

IUPACN-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide
SMILESCC(=O)Nc1c(C)ccc2c1C(C)CC21CCCC1
InChIInChI=1S/C17H23NO/c1-11-6-7-14-15(16(11)18-13(3)19)12(2)10-17(14)8-4-5-9-17/h6-7,12H,4-5,8-10H2,1-3H3,(H,18,19)
InChIKeyKDWAVVNDFMHQCK-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.27
Rot. Bonds1

About N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide

N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide (PubChem CID 3850125) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide.

Molecular Properties

Compound NameN-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide
PubChem CID3850125
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC NameN-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide
SMILESCC(=O)Nc1c(C)ccc2c1C(C)CC21CCCC1
InChIInChI=1S/C17H23NO/c1-11-6-7-14-15(16(11)18-13(3)19)12(2)10-17(14)8-4-5-9-17/h6-7,12H,4-5,8-10H2,1-3H3,(H,18,19)
InChIKeyKDWAVVNDFMHQCK-UHFFFAOYSA-N
XLogP4.27
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide?
The IUPAC name of N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide (CID 3850125) is N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide.
What is the SMILES notation for N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide?
The canonical SMILES for N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide is CC(=O)Nc1c(C)ccc2c1C(C)CC21CCCC1.
What is the InChIKey of N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide?
The InChIKey is KDWAVVNDFMHQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-11-6-7-14-15(16(11)18-13(3)19)12(2)10-17(14)8-4-5-9-17/h6-7,12H,4-5,8-10H2,1-3H3,(H,18,19).
What are the key properties of N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide?
N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide has a molecular weight of 257.38 g/mol, XLogP of 4.27, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylspiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl)acetamide is sourced from PubChem (CID 3850125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).