spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide

C12H13NO — CID 175851005

IUPACspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide
SMILESNC(=O)c1ccc2c(c1)C1(CC2)CC1
InChIInChI=1S/C12H13NO/c13-11(14)9-2-1-8-3-4-12(5-6-12)10(8)7-9/h1-2,7H,3-6H2,(H2,13,14)
InChIKeyZWVLMDQLSOVGIC-UHFFFAOYSA-N
MW187.24 g/mol
LogP1.76
Rot. Bonds1

About spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide

spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide (PubChem CID 175851005) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide.

Molecular Properties

Compound Namespiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide
PubChem CID175851005
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Namespiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide
SMILESNC(=O)c1ccc2c(c1)C1(CC2)CC1
InChIInChI=1S/C12H13NO/c13-11(14)9-2-1-8-3-4-12(5-6-12)10(8)7-9/h1-2,7H,3-6H2,(H2,13,14)
InChIKeyZWVLMDQLSOVGIC-UHFFFAOYSA-N
XLogP1.76
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide?
The IUPAC name of spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide (CID 175851005) is spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide.
What is the SMILES notation for spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide?
The canonical SMILES for spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide is NC(=O)c1ccc2c(c1)C1(CC2)CC1.
What is the InChIKey of spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide?
The InChIKey is ZWVLMDQLSOVGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c13-11(14)9-2-1-8-3-4-12(5-6-12)10(8)7-9/h1-2,7H,3-6H2,(H2,13,14).
What are the key properties of spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide?
spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide has a molecular weight of 187.24 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxamide is sourced from PubChem (CID 175851005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).