N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide

C22H19FN2O — CID 89158744

IUPACN-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESNc1ccc(-c2ccc(F)cc2)cc1NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C22H19FN2O/c23-19-8-5-14(6-9-19)17-7-10-20(24)21(13-17)25-22(26)18-11-15-3-1-2-4-16(15)12-18/h1-10,13,18H,11-12,24H2,(H,25,26)
InChIKeyIZOSWVCYHXRMOP-UHFFFAOYSA-N
MW346.41 g/mol
LogP4.43
Rot. Bonds3

About N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide

N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 89158744) has the molecular formula C22H19FN2O and a molecular weight of 346.41 g/mol. Its IUPAC name is N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID89158744
Molecular FormulaC22H19FN2O
Molecular Weight346.41 g/mol
Exact Mass346.15
IUPAC NameN-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESNc1ccc(-c2ccc(F)cc2)cc1NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C22H19FN2O/c23-19-8-5-14(6-9-19)17-7-10-20(24)21(13-17)25-22(26)18-11-15-3-1-2-4-16(15)12-18/h1-10,13,18H,11-12,24H2,(H,25,26)
InChIKeyIZOSWVCYHXRMOP-UHFFFAOYSA-N
XLogP4.43
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide (CID 89158744) is N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide is Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)C1Cc2ccccc2C1.
What is the InChIKey of N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is IZOSWVCYHXRMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O/c23-19-8-5-14(6-9-19)17-7-10-20(24)21(13-17)25-22(26)18-11-15-3-1-2-4-16(15)12-18/h1-10,13,18H,11-12,24H2,(H,25,26).
What are the key properties of N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 346.41 g/mol, XLogP of 4.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-(4-fluorophenyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 89158744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).