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

C16H17N3O2 — CID 582509

IUPAC2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
SMILESNC(Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1
InChIInChI=1S/C16H17N3O2/c17-14(16(20)19-10-12-4-3-7-21-12)8-11-9-18-15-6-2-1-5-13(11)15/h1-7,9,14,18H,8,10,17H2,(H,19,20)
InChIKeyFQLXKOCHDBPFLL-UHFFFAOYSA-N
MW283.33 g/mol
LogP1.95
Rot. Bonds5

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

2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide (PubChem CID 582509) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound Name2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
PubChem CID582509
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
SMILESNC(Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1
InChIInChI=1S/C16H17N3O2/c17-14(16(20)19-10-12-4-3-7-21-12)8-11-9-18-15-6-2-1-5-13(11)15/h1-7,9,14,18H,8,10,17H2,(H,19,20)
InChIKeyFQLXKOCHDBPFLL-UHFFFAOYSA-N
XLogP1.95
TPSA84.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 51.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-amino-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 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
The IUPAC name of 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide (CID 582509) is 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide is NC(Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1.
What is the InChIKey of 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
The InChIKey is FQLXKOCHDBPFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c17-14(16(20)19-10-12-4-3-7-21-12)8-11-9-18-15-6-2-1-5-13(11)15/h1-7,9,14,18H,8,10,17H2,(H,19,20).
What are the key properties of 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide?
2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide has a molecular weight of 283.33 g/mol, XLogP of 1.95, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 582509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).