N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide

C14H18FNO — CID 151386145

IUPACN-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide
SMILESCCCCC(=O)NC1CCc2ccc(F)cc21
InChIInChI=1S/C14H18FNO/c1-2-3-4-14(17)16-13-8-6-10-5-7-11(15)9-12(10)13/h5,7,9,13H,2-4,6,8H2,1H3,(H,16,17)
InChIKeyOTLFWWGYCTVDRH-UHFFFAOYSA-N
MW235.30 g/mol
LogP3.12
Rot. Bonds4

About N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide

N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide (PubChem CID 151386145) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide.

Molecular Properties

Compound NameN-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide
PubChem CID151386145
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC NameN-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide
SMILESCCCCC(=O)NC1CCc2ccc(F)cc21
InChIInChI=1S/C14H18FNO/c1-2-3-4-14(17)16-13-8-6-10-5-7-11(15)9-12(10)13/h5,7,9,13H,2-4,6,8H2,1H3,(H,16,17)
InChIKeyOTLFWWGYCTVDRH-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
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-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide?
The IUPAC name of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide (CID 151386145) is N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide.
What is the SMILES notation for N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide?
The canonical SMILES for N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide is CCCCC(=O)NC1CCc2ccc(F)cc21.
What is the InChIKey of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide?
The InChIKey is OTLFWWGYCTVDRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-2-3-4-14(17)16-13-8-6-10-5-7-11(15)9-12(10)13/h5,7,9,13H,2-4,6,8H2,1H3,(H,16,17).
What are the key properties of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide?
N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide has a molecular weight of 235.30 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)pentanamide is sourced from PubChem (CID 151386145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).