N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide

C15H18FNO — CID 47380198

IUPACN-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCc2cc(F)ccc21)C1CCCC1
InChIInChI=1S/C15H18FNO/c16-12-6-7-13-11(9-12)5-8-14(13)17-15(18)10-3-1-2-4-10/h6-7,9-10,14H,1-5,8H2,(H,17,18)
InChIKeyOADDDMAYEMPXOG-UHFFFAOYSA-N
MW247.31 g/mol
LogP3.12
Rot. Bonds2

About N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide

N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide (PubChem CID 47380198) has the molecular formula C15H18FNO and a molecular weight of 247.31 g/mol. Its IUPAC name is N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide
PubChem CID47380198
Molecular FormulaC15H18FNO
Molecular Weight247.31 g/mol
Exact Mass247.14
IUPAC NameN-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCc2cc(F)ccc21)C1CCCC1
InChIInChI=1S/C15H18FNO/c16-12-6-7-13-11(9-12)5-8-14(13)17-15(18)10-3-1-2-4-10/h6-7,9-10,14H,1-5,8H2,(H,17,18)
InChIKeyOADDDMAYEMPXOG-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide?
The IUPAC name of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide (CID 47380198) is N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide is O=C(NC1CCc2cc(F)ccc21)C1CCCC1.
What is the InChIKey of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide?
The InChIKey is OADDDMAYEMPXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO/c16-12-6-7-13-11(9-12)5-8-14(13)17-15(18)10-3-1-2-4-10/h6-7,9-10,14H,1-5,8H2,(H,17,18).
What are the key properties of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide?
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide has a molecular weight of 247.31 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)cyclopentanecarboxamide is sourced from PubChem (CID 47380198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).