N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide

C16H16N2O2 — CID 582676

IUPACN-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)NCc1ccco1
InChIInChI=1S/C16H16N2O2/c19-16(18-11-13-4-3-9-20-13)8-7-12-10-17-15-6-2-1-5-14(12)15/h1-6,9-10,17H,7-8,11H2,(H,18,19)
InChIKeyRMJKQZLPANPENR-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.01
Rot. Bonds5

About N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide

N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide (PubChem CID 582676) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
PubChem CID582676
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)NCc1ccco1
InChIInChI=1S/C16H16N2O2/c19-16(18-11-13-4-3-9-20-13)8-7-12-10-17-15-6-2-1-5-14(12)15/h1-6,9-10,17H,7-8,11H2,(H,18,19)
InChIKeyRMJKQZLPANPENR-UHFFFAOYSA-N
XLogP3.01
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide (CID 582676) is N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide is O=C(CCc1c[nH]c2ccccc12)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
The InChIKey is RMJKQZLPANPENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-16(18-11-13-4-3-9-20-13)8-7-12-10-17-15-6-2-1-5-14(12)15/h1-6,9-10,17H,7-8,11H2,(H,18,19).
What are the key properties of N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide has a molecular weight of 268.32 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 582676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).