N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide

C15H9ClF2N2O — CID 113207472

IUPACN-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1cc2ccc(F)cc2[nH]1
InChIInChI=1S/C15H9ClF2N2O/c16-11-7-10(3-4-12(11)18)19-15(21)14-5-8-1-2-9(17)6-13(8)20-14/h1-7,20H,(H,19,21)
InChIKeyTXOMHWRNYSNKNX-UHFFFAOYSA-N
MW306.70 g/mol
LogP4.35
Rot. Bonds2

About N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide

N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide (PubChem CID 113207472) has the molecular formula C15H9ClF2N2O and a molecular weight of 306.70 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide
PubChem CID113207472
Molecular FormulaC15H9ClF2N2O
Molecular Weight306.70 g/mol
Exact Mass306.04
IUPAC NameN-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1cc2ccc(F)cc2[nH]1
InChIInChI=1S/C15H9ClF2N2O/c16-11-7-10(3-4-12(11)18)19-15(21)14-5-8-1-2-9(17)6-13(8)20-14/h1-7,20H,(H,19,21)
InChIKeyTXOMHWRNYSNKNX-UHFFFAOYSA-N
XLogP4.35
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.70
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-chloro-4-fluorophenyl)-5,6-dimethoxy-1H-indole-2-carboxamide
CID 7679189
5-chloro-N-(3,4-difluorophenyl)-1H-indole-2-carboxamide
CID 113207264
N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide
CID 113207573
6-chloro-N-(4-cyanophenyl)-1H-indole-2-carboxamide
CID 113207612
2-(4-chlorophenyl)-1-(6-fluoro-1H-indol-2-yl)-2-methylpropan-1-one
CID 11565910
N-[4-(2-amino-2-oxoethyl)phenyl]-6-chloro-1H-indole-2-carboxamide
CID 31862421
ethyl N-[4-[(6-chloro-1H-indole-2-carbonyl)amino]phenyl]carbamate
CID 60515896
N-(3-fluorophenyl)-6-methoxy-1H-indole-2-carboxamide
CID 110862680
4-[(3-chloro-4-fluorophenyl)carbamoyl]benzoic acid
CID 43386528
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
N-(4-carbamoylphenyl)-5-fluoro-1H-indole-2-carboxamide
CID 46557885
N-[4-chloro-3-(trifluoromethyl)phenyl]-7-fluoro-2-oxo-1H-quinoline-3-carboxamide
CID 110427041

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide (CID 113207472) is N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide is O=C(Nc1ccc(F)c(Cl)c1)c1cc2ccc(F)cc2[nH]1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide?
The InChIKey is TXOMHWRNYSNKNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClF2N2O/c16-11-7-10(3-4-12(11)18)19-15(21)14-5-8-1-2-9(17)6-13(8)20-14/h1-7,20H,(H,19,21).
What are the key properties of N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide?
N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide has a molecular weight of 306.70 g/mol, XLogP of 4.35, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide is sourced from PubChem (CID 113207472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).