2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole

C19H17FN2O — CID 31673406

IUPAC2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole
SMILESC[C@@H]1Cc2ccccc2N1Cc1coc(-c2ccc(F)cc2)n1
InChIInChI=1S/C19H17FN2O/c1-13-10-15-4-2-3-5-18(15)22(13)11-17-12-23-19(21-17)14-6-8-16(20)9-7-14/h2-9,12-13H,10-11H2,1H3/t13-/m1/s1
InChIKeyNYPXCKHLKOZBOE-CYBMUJFWSA-N
MW308.36 g/mol
LogP4.43
Rot. Bonds3

About 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole

2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole (PubChem CID 31673406) has the molecular formula C19H17FN2O and a molecular weight of 308.36 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole
PubChem CID31673406
Molecular FormulaC19H17FN2O
Molecular Weight308.36 g/mol
Exact Mass308.13
IUPAC Name2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole
SMILESC[C@@H]1Cc2ccccc2N1Cc1coc(-c2ccc(F)cc2)n1
InChIInChI=1S/C19H17FN2O/c1-13-10-15-4-2-3-5-18(15)22(13)11-17-12-23-19(21-17)14-6-8-16(20)9-7-14/h2-9,12-13H,10-11H2,1H3/t13-/m1/s1
InChIKeyNYPXCKHLKOZBOE-CYBMUJFWSA-N
XLogP4.43
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenyl)-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-1,3-oxazole
CID 42943788
(2R)-1-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2-methyl-2,3-dihydroindole-5-sulfonamide
CID 51725307
1-[(4-fluorophenyl)methyl]-2-methyl-2,3-dihydroindole
CID 22199928
[6-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-2-pyridinyl]methanamine
CID 106905554
[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
CID 63288980
1-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]-3-methylpiperidin-4-ol
CID 114681165
1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]-N-methylmethanamine
CID 60726482
6-[(2-methyl-2,3-dihydroindol-1-yl)methyl]pyridin-3-ol
CID 82974751
1-[1-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]piperidin-2-yl]ethanol
CID 111106797
3-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 31688665
5-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
CID 25342936
1-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]-N-methylpiperidin-3-amine
CID 62547236

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole?
The IUPAC name of 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole (CID 31673406) is 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole.
What is the SMILES notation for 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole?
The canonical SMILES for 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole is C[C@@H]1Cc2ccccc2N1Cc1coc(-c2ccc(F)cc2)n1.
What is the InChIKey of 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole?
The InChIKey is NYPXCKHLKOZBOE-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H17FN2O/c1-13-10-15-4-2-3-5-18(15)22(13)11-17-12-23-19(21-17)14-6-8-16(20)9-7-14/h2-9,12-13H,10-11H2,1H3/t13-/m1/s1.
What are the key properties of 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole?
2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole has a molecular weight of 308.36 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole is sourced from PubChem (CID 31673406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).