N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide

C14H17NO — CID 47129715

IUPACN-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide
SMILESO=C(NC1CCc2ccccc21)C1CCC1
InChIInChI=1S/C14H17NO/c16-14(11-5-3-6-11)15-13-9-8-10-4-1-2-7-12(10)13/h1-2,4,7,11,13H,3,5-6,8-9H2,(H,15,16)
InChIKeyNQHQCRJCCDLJMZ-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.59
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide

N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide (PubChem CID 47129715) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide
PubChem CID47129715
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide
SMILESO=C(NC1CCc2ccccc21)C1CCC1
InChIInChI=1S/C14H17NO/c16-14(11-5-3-6-11)15-13-9-8-10-4-1-2-7-12(10)13/h1-2,4,7,11,13H,3,5-6,8-9H2,(H,15,16)
InChIKeyNQHQCRJCCDLJMZ-UHFFFAOYSA-N
XLogP2.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide (CID 47129715) is N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide is O=C(NC1CCc2ccccc21)C1CCC1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide?
The InChIKey is NQHQCRJCCDLJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c16-14(11-5-3-6-11)15-13-9-8-10-4-1-2-7-12(10)13/h1-2,4,7,11,13H,3,5-6,8-9H2,(H,15,16).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide?
N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide has a molecular weight of 215.30 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide is sourced from PubChem (CID 47129715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).