N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide

C14H13FN2O2 — CID 47387060

IUPACN-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCc3cc(F)ccc32)no1
InChIInChI=1S/C14H13FN2O2/c1-8-6-13(17-19-8)14(18)16-12-5-2-9-7-10(15)3-4-11(9)12/h3-4,6-7,12H,2,5H2,1H3,(H,16,18)
InChIKeyWLWNFPPJNNVTDP-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.54
Rot. Bonds2

About N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide

N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 47387060) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID47387060
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC NameN-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCc3cc(F)ccc32)no1
InChIInChI=1S/C14H13FN2O2/c1-8-6-13(17-19-8)14(18)16-12-5-2-9-7-10(15)3-4-11(9)12/h3-4,6-7,12H,2,5H2,1H3,(H,16,18)
InChIKeyWLWNFPPJNNVTDP-UHFFFAOYSA-N
XLogP2.54
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide
CID 79741279
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1H-pyrazole-3-carboxamide
CID 47380214
3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide
CID 119037715
N-[(1S)-5-fluoro-2,3-dihydro-1H-inden-1-yl]cyclobutanecarboxamide
CID 94198795
3-[(5-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-2-methyl-3-oxopropanoic acid
CID 122065402
N-[2-[[(1S)-5-fluoro-2,3-dihydro-1H-inden-1-yl]amino]-2-oxoethyl]propanamide
CID 94212219
2-methyl-N-[5-(5-methyl-1,2-oxazol-3-yl)-2,3-dihydro-1H-inden-1-yl]pyridine-4-carboxamide
CID 139412582
2-(1,2-benzoxazol-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide
CID 51092558
3-amino-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)butanamide
CID 119745353
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-4-methyl-2,3-dihydro-1,4-benzoxazine-6-carboxamide
CID 139000372
N-[(4R)-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 95383304
1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-[(4-methylphenyl)methyl]urea
CID 60577386

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide (CID 47387060) is N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)NC2CCc3cc(F)ccc32)no1.
What is the InChIKey of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is WLWNFPPJNNVTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c1-8-6-13(17-19-8)14(18)16-12-5-2-9-7-10(15)3-4-11(9)12/h3-4,6-7,12H,2,5H2,1H3,(H,16,18).
What are the key properties of N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide?
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 260.27 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 47387060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).