N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide

C17H17FN2O — CID 108901276

IUPACN-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide
SMILESO=C(NCCc1cccc(F)c1)N1CCc2ccccc21
InChIInChI=1S/C17H17FN2O/c18-15-6-3-4-13(12-15)8-10-19-17(21)20-11-9-14-5-1-2-7-16(14)20/h1-7,12H,8-11H2,(H,19,21)
InChIKeyCFRLJQXCERULEL-UHFFFAOYSA-N
MW284.33 g/mol
LogP3.14
Rot. Bonds3

About N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide

N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide (PubChem CID 108901276) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide
PubChem CID108901276
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC NameN-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide
SMILESO=C(NCCc1cccc(F)c1)N1CCc2ccccc21
InChIInChI=1S/C17H17FN2O/c18-15-6-3-4-13(12-15)8-10-19-17(21)20-11-9-14-5-1-2-7-16(14)20/h1-7,12H,8-11H2,(H,19,21)
InChIKeyCFRLJQXCERULEL-UHFFFAOYSA-N
XLogP3.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(3-carbamoylphenyl)ethyl]-5-fluoro-2,3-dihydroindole-1-carboxamide
CID 167974029
N-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,3-dihydroindole-1-carboxamide
CID 113217130
2-(3-fluorophenyl)ethylcarbamothioic S-acid
CID 115170336
N-benzyl-5-fluoro-2,3-dihydroindole-1-carboxamide
CID 110747443
1-(2,3-dihydroindol-1-yl)-3-(3-fluoroanilino)propan-1-one
CID 109034782
N-(2-methoxyethyl)-2,3-dihydroindole-1-carboxamide
CID 47193672
N-(3-phenylpropyl)-3,4-dihydro-2H-quinoline-1-carboxamide
CID 108990483
3-(2,3-dihydroindol-1-yl)-N-[2-(3-methoxyphenyl)ethyl]-3-oxopropanamide
CID 108948672
N-(3-phenylpropyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69224185
(2R)-1-(2,3-dihydroindol-1-yl)-2-[(3-fluorophenyl)methyl-methylamino]propan-1-one
CID 8516194
2,3-dihydroindol-1-yl-[1-[(3-fluorophenyl)methyl]pyrrolidin-3-yl]methanone
CID 172904104
N-(2-cyclopentylethyl)-2,3-dihydroindole-1-carboxamide
CID 126767555

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide (CID 108901276) is N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide is O=C(NCCc1cccc(F)c1)N1CCc2ccccc21.
What is the InChIKey of N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is CFRLJQXCERULEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O/c18-15-6-3-4-13(12-15)8-10-19-17(21)20-11-9-14-5-1-2-7-16(14)20/h1-7,12H,8-11H2,(H,19,21).
What are the key properties of N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide?
N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 284.33 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)ethyl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 108901276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).