N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide

C14H14N2O2 — CID 79741002

IUPACN-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide
SMILESNc1ccc2c(c1)CCC2NC(=O)c1ccco1
InChIInChI=1S/C14H14N2O2/c15-10-4-5-11-9(8-10)3-6-12(11)16-14(17)13-2-1-7-18-13/h1-2,4-5,7-8,12H,3,6,15H2,(H,16,17)
InChIKeyVUTKFVBFQRGCKK-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.28
Rot. Bonds2

About N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide

N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide (PubChem CID 79741002) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide
PubChem CID79741002
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC NameN-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide
SMILESNc1ccc2c(c1)CCC2NC(=O)c1ccco1
InChIInChI=1S/C14H14N2O2/c15-10-4-5-11-9(8-10)3-6-12(11)16-14(17)13-2-1-7-18-13/h1-2,4-5,7-8,12H,3,6,15H2,(H,16,17)
InChIKeyVUTKFVBFQRGCKK-UHFFFAOYSA-N
XLogP2.28
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(5-amino-2,3-dihydro-1H-inden-1-yl)-2-chlorofuran-3-carboxamide
CID 106688572
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-3-carboxamide
CID 79741645
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-4-hydroxybenzamide
CID 79741651
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-4-bromobenzamide
CID 79740821
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide
CID 79741279
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-3-methylbenzamide
CID 79723212
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-3-bromo-2-methylbenzamide
CID 79722653
N-(5-amino-2,3-dihydro-1H-inden-1-yl)thiadiazole-4-carboxamide
CID 79741093
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-4-methylbenzamide
CID 79723797
4-amino-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167568086
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-5-chloro-2-methylbenzamide
CID 82870824
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-3-chloro-4-iodobenzamide
CID 103209666

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide?
The IUPAC name of N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide (CID 79741002) is N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide.
What is the SMILES notation for N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide?
The canonical SMILES for N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide is Nc1ccc2c(c1)CCC2NC(=O)c1ccco1.
What is the InChIKey of N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide?
The InChIKey is VUTKFVBFQRGCKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c15-10-4-5-11-9(8-10)3-6-12(11)16-14(17)13-2-1-7-18-13/h1-2,4-5,7-8,12H,3,6,15H2,(H,16,17).
What are the key properties of N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide?
N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,3-dihydro-1H-inden-1-yl)furan-2-carboxamide is sourced from PubChem (CID 79741002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).