2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine

C14H17FN4O — CID 103815804

IUPAC2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine
SMILESCC(C)(N)c1noc(CN2CCc3ccc(F)cc32)n1
InChIInChI=1S/C14H17FN4O/c1-14(2,16)13-17-12(20-18-13)8-19-6-5-9-3-4-10(15)7-11(9)19/h3-4,7H,5-6,8,16H2,1-2H3
InChIKeyNGRYDHHBYPQUFT-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.97
Rot. Bonds3

About 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine

2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine (PubChem CID 103815804) has the molecular formula C14H17FN4O and a molecular weight of 276.32 g/mol. Its IUPAC name is 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine.

Molecular Properties

Compound Name2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine
PubChem CID103815804
Molecular FormulaC14H17FN4O
Molecular Weight276.32 g/mol
Exact Mass276.14
IUPAC Name2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine
SMILESCC(C)(N)c1noc(CN2CCc3ccc(F)cc32)n1
InChIInChI=1S/C14H17FN4O/c1-14(2,16)13-17-12(20-18-13)8-19-6-5-9-3-4-10(15)7-11(9)19/h3-4,7H,5-6,8,16H2,1-2H3
InChIKeyNGRYDHHBYPQUFT-UHFFFAOYSA-N
XLogP1.97
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
CID 71881958
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,3-benzoxazol-4-amine
CID 103494165
1-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2-oxazol-3-yl]-N-methylmethanamine
CID 103503080
1-[(6-fluoro-1,3-benzoxazol-2-yl)methyl]-2,3-dihydroindole-6-sulfonamide
CID 71971133
4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]thiadiazol-5-amine
CID 103502277
N-ethyl-5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 103502305
2-[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 54857179
N-[[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]thiophen-2-yl]methyl]ethanamine
CID 107557641
1-[(4-bromophenyl)methyl]-6-fluoro-2,3-dihydroindole
CID 103501587
5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-N-propyl-1,3,4-thiadiazol-2-amine
CID 103502310
5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-3-methylfuran-2-carboxylic acid
CID 103498030
4-(6-fluoro-2,3-dihydroindol-1-yl)-2,2-dimethylbutanethioamide
CID 103495730

Frequently Asked Questions

What is the IUPAC name of 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine?
The IUPAC name of 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine (CID 103815804) is 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine.
What is the SMILES notation for 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine?
The canonical SMILES for 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine is CC(C)(N)c1noc(CN2CCc3ccc(F)cc32)n1.
What is the InChIKey of 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine?
The InChIKey is NGRYDHHBYPQUFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4O/c1-14(2,16)13-17-12(20-18-13)8-19-6-5-9-3-4-10(15)7-11(9)19/h3-4,7H,5-6,8,16H2,1-2H3.
What are the key properties of 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine?
2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine has a molecular weight of 276.32 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine is sourced from PubChem (CID 103815804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).