N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide

C15H13N3O2 — CID 5340769

IUPACN-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide
SMILESC/C(=N\NC(=O)c1c[nH]c2ccccc12)c1ccco1
InChIInChI=1S/C15H13N3O2/c1-10(14-7-4-8-20-14)17-18-15(19)12-9-16-13-6-3-2-5-11(12)13/h2-9,16H,1H3,(H,18,19)/b17-10+
InChIKeyMOYROPUYGGGBOL-LICLKQGHSA-N
MW267.29 g/mol
LogP2.91
Rot. Bonds3

About N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide

N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide (PubChem CID 5340769) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide
PubChem CID5340769
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide
SMILESC/C(=N\NC(=O)c1c[nH]c2ccccc12)c1ccco1
InChIInChI=1S/C15H13N3O2/c1-10(14-7-4-8-20-14)17-18-15(19)12-9-16-13-6-3-2-5-11(12)13/h2-9,16H,1H3,(H,18,19)/b17-10+
InChIKeyMOYROPUYGGGBOL-LICLKQGHSA-N
XLogP2.91
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide
CID 807650
N-[(Z)-1-(5-methylfuran-2-yl)ethylideneamino]-1H-indole-3-carboxamide
CID 5411742
N-(propan-2-ylideneamino)-1H-indole-3-carboxamide
CID 3706712
N-[1-(4-fluorophenyl)ethylideneamino]-1H-indole-3-carboxamide
CID 3109037
N-[1-(4-ethylphenyl)ethylideneamino]-1H-indole-3-carboxamide
CID 3447704
2-hydroxy-N-[(Z)-1-(1H-indol-3-yl)ethylideneamino]benzamide
CID 136801988
N-[(E)-1-(furan-2-yl)ethylideneamino]furan-2-carboxamide
CID 5339845
N-[2-(furan-2-carbonylamino)ethyl]-1H-indole-3-carboxamide
CID 42581260
N-[(Z)-1-(3-bromophenyl)ethylideneamino]-1H-indole-3-carboxamide
CID 6242879
N-(heptan-4-ylideneamino)-1H-indole-3-carboxamide
CID 5146585
N-[(E)-1-(furan-2-yl)ethylideneamino]-2-phenylacetamide
CID 5335640
N-[(Z)-1-(2,5-dimethoxyphenyl)ethylideneamino]-1H-indole-3-carboxamide
CID 6260157

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide?
The IUPAC name of N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide (CID 5340769) is N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide.
What is the SMILES notation for N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide?
The canonical SMILES for N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide is C/C(=N\NC(=O)c1c[nH]c2ccccc12)c1ccco1.
What is the InChIKey of N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide?
The InChIKey is MOYROPUYGGGBOL-LICLKQGHSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-10(14-7-4-8-20-14)17-18-15(19)12-9-16-13-6-3-2-5-11(12)13/h2-9,16H,1H3,(H,18,19)/b17-10+.
What are the key properties of N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide?
N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(furan-2-yl)ethylideneamino]-1H-indole-3-carboxamide is sourced from PubChem (CID 5340769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).