N-(3,4-difluorophenyl)-1H-indole-5-carboxamide

C15H10F2N2O — CID 63718780

IUPACN-(3,4-difluorophenyl)-1H-indole-5-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H10F2N2O/c16-12-3-2-11(8-13(12)17)19-15(20)10-1-4-14-9(7-10)5-6-18-14/h1-8,18H,(H,19,20)
InChIKeyRGSZHUXDBOHTNC-UHFFFAOYSA-N
MW272.25 g/mol
LogP3.70
Rot. Bonds2

About N-(3,4-difluorophenyl)-1H-indole-5-carboxamide

N-(3,4-difluorophenyl)-1H-indole-5-carboxamide (PubChem CID 63718780) has the molecular formula C15H10F2N2O and a molecular weight of 272.25 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-1H-indole-5-carboxamide
PubChem CID63718780
Molecular FormulaC15H10F2N2O
Molecular Weight272.25 g/mol
Exact Mass272.08
IUPAC NameN-(3,4-difluorophenyl)-1H-indole-5-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H10F2N2O/c16-12-3-2-11(8-13(12)17)19-15(20)10-1-4-14-9(7-10)5-6-18-14/h1-8,18H,(H,19,20)
InChIKeyRGSZHUXDBOHTNC-UHFFFAOYSA-N
XLogP3.70
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.25
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-fluoro-3-methoxyphenyl)-1H-indole-5-carboxamide
CID 114840582
N-[3-fluoro-4-[4-(1H-pyrrole-3-carbonylamino)anilino]phenyl]-1H-indole-5-carboxamide
CID 67113599
N-(3-chlorophenyl)-1H-indole-5-carboxamide
CID 55230182
3,5-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571909
N-(3-fluoro-4-methoxyphenyl)-1H-indole-6-carboxamide
CID 60971449
N-(1H-indol-5-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61250452
N-(3,4-difluorophenyl)naphthalene-2-carboxamide
CID 7771728
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1H-indole-5-carboxamide
CID 112523027
N-(1H-indol-5-yl)-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carboxamide
CID 11559292
N-(3-ethylphenyl)-1H-indole-5-carboxamide
CID 63717864
3-[4-(1H-indole-5-carbonylamino)phenyl]propanoic acid
CID 75495645
N-(3,4-difluorophenyl)-1H-pyrrole-3-carboxamide
CID 110691221

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-1H-indole-5-carboxamide?
The IUPAC name of N-(3,4-difluorophenyl)-1H-indole-5-carboxamide (CID 63718780) is N-(3,4-difluorophenyl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(3,4-difluorophenyl)-1H-indole-5-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-(3,4-difluorophenyl)-1H-indole-5-carboxamide?
The InChIKey is RGSZHUXDBOHTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O/c16-12-3-2-11(8-13(12)17)19-15(20)10-1-4-14-9(7-10)5-6-18-14/h1-8,18H,(H,19,20).
What are the key properties of N-(3,4-difluorophenyl)-1H-indole-5-carboxamide?
N-(3,4-difluorophenyl)-1H-indole-5-carboxamide has a molecular weight of 272.25 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-1H-indole-5-carboxamide is sourced from PubChem (CID 63718780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).