N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide

C17H13FN2O — CID 106703249

IUPACN-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESN#Cc1c(F)cccc1NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C17H13FN2O/c18-15-6-3-7-16(14(15)10-19)20-17(21)13-8-11-4-1-2-5-12(11)9-13/h1-7,13H,8-9H2,(H,20,21)
InChIKeyHYHWKJIPPDXCFW-UHFFFAOYSA-N
MW280.30 g/mol
LogP3.05
Rot. Bonds2

About N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide

N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106703249) has the molecular formula C17H13FN2O and a molecular weight of 280.30 g/mol. Its IUPAC name is N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106703249
Molecular FormulaC17H13FN2O
Molecular Weight280.30 g/mol
Exact Mass280.10
IUPAC NameN-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESN#Cc1c(F)cccc1NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C17H13FN2O/c18-15-6-3-7-16(14(15)10-19)20-17(21)13-8-11-4-1-2-5-12(11)9-13/h1-7,13H,8-9H2,(H,20,21)
InChIKeyHYHWKJIPPDXCFW-UHFFFAOYSA-N
XLogP3.05
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyano-3-fluorophenyl)cyclopropanecarboxamide
CID 43580354
N-(2-cyanophenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106737104
N-(2-cyano-3-fluorophenyl)oxolane-3-carboxamide
CID 61276767
N-(2-cyano-3-fluorophenyl)piperidine-3-carboxamide
CID 43580743
3-amino-N-(2-cyano-3-fluorophenyl)cyclohexane-1-carboxamide
CID 63041812
1-(2-chlorophenyl)-3-(2-cyano-3-fluorophenyl)urea
CID 43580526
5-[(2-cyano-3-fluorophenyl)carbamoyl]oxolane-2-carboxylic acid
CID 102687786
2-amino-N-(2-cyano-3-fluorophenyl)cyclohexane-1-carboxamide
CID 64824294
N-(2-cyano-3-fluorophenyl)oxolane-2-carboxamide
CID 43580330
N-(2-cyano-3-fluorophenyl)pyrrolidine-1-carboxamide
CID 78954561
N-(5-chloro-2-cyanophenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106892899
N-(2-cyano-3-fluorophenyl)-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide
CID 71999484

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide (CID 106703249) is N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide is N#Cc1c(F)cccc1NC(=O)C1Cc2ccccc2C1.
What is the InChIKey of N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is HYHWKJIPPDXCFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O/c18-15-6-3-7-16(14(15)10-19)20-17(21)13-8-11-4-1-2-5-12(11)9-13/h1-7,13H,8-9H2,(H,20,21).
What are the key properties of N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 280.30 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-3-fluorophenyl)-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106703249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).