N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide

C16H15FN2O — CID 80566409

IUPACN-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide
SMILESCc1cc(NC(=O)C2CNc3ccccc32)ccc1F
InChIInChI=1S/C16H15FN2O/c1-10-8-11(6-7-14(10)17)19-16(20)13-9-18-15-5-3-2-4-12(13)15/h2-8,13,18H,9H2,1H3,(H,19,20)
InChIKeyQUNCTZXPSVYTFN-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.28
Rot. Bonds2

About N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide

N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide (PubChem CID 80566409) has the molecular formula C16H15FN2O and a molecular weight of 270.31 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide
PubChem CID80566409
Molecular FormulaC16H15FN2O
Molecular Weight270.31 g/mol
Exact Mass270.12
IUPAC NameN-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide
SMILESCc1cc(NC(=O)C2CNc3ccccc32)ccc1F
InChIInChI=1S/C16H15FN2O/c1-10-8-11(6-7-14(10)17)19-16(20)13-9-18-15-5-3-2-4-12(13)15/h2-8,13,18H,9H2,1H3,(H,19,20)
InChIKeyQUNCTZXPSVYTFN-UHFFFAOYSA-N
XLogP3.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluoro-5-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80567216
N-(4-fluoro-3-methylphenyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
CID 62811648
N-(2-fluorophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80566014
N-(3-bromophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80565871
N-(4-bromo-2,5-difluorophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 107611758
N-[3-(hydroxymethyl)phenyl]-2,3-dihydro-1H-indole-3-carboxamide
CID 80565407
(2S)-N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 62813197
N-pyrimidin-5-yl-2,3-dihydro-1H-indole-3-carboxamide
CID 107588629
N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 107625638
N-[4-(cyanomethyl)phenyl]-2,3-dihydro-1H-indole-3-carboxamide
CID 80564486
N-(3,4-dimethylphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65260503
N-(1,2-oxazol-4-yl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80566319

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide (CID 80566409) is N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide is Cc1cc(NC(=O)C2CNc3ccccc32)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide?
The InChIKey is QUNCTZXPSVYTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O/c1-10-8-11(6-7-14(10)17)19-16(20)13-9-18-15-5-3-2-4-12(13)15/h2-8,13,18H,9H2,1H3,(H,19,20).
What are the key properties of N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide?
N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide has a molecular weight of 270.31 g/mol, XLogP of 3.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-3-carboxamide is sourced from PubChem (CID 80566409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).