N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide

C15H19N3O2 — CID 43526612

IUPACN-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
SMILESCC(C(=O)Nc1ccccc1N)N(C)Cc1ccco1
InChIInChI=1S/C15H19N3O2/c1-11(18(2)10-12-6-5-9-20-12)15(19)17-14-8-4-3-7-13(14)16/h3-9,11H,10,16H2,1-2H3,(H,17,19)
InChIKeyRVPONKSVEQMWOV-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.32
Rot. Bonds5

About N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide

N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide (PubChem CID 43526612) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
PubChem CID43526612
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
SMILESCC(C(=O)Nc1ccccc1N)N(C)Cc1ccco1
InChIInChI=1S/C15H19N3O2/c1-11(18(2)10-12-6-5-9-20-12)15(19)17-14-8-4-3-7-13(14)16/h3-9,11H,10,16H2,1-2H3,(H,17,19)
InChIKeyRVPONKSVEQMWOV-UHFFFAOYSA-N
XLogP2.32
TPSA71.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide 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-(4-amino-2-methylphenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 43526601
N-(2-aminophenyl)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
CID 61426661
(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 9334007
N-(2-aminophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]propanamide
CID 43527265
2-[(2-aminophenyl)methyl-methylamino]-N-(furan-2-ylmethyl)propanamide
CID 43458642
N-(2-aminophenyl)-2-[methyl(2-methylbutyl)amino]propanamide
CID 43295395
N-(2-aminophenyl)-2-(furan-2-ylmethylsulfanyl)propanamide
CID 43125023
2-[furan-2-ylmethyl(methyl)amino]-N-(4-nitrophenyl)propanamide
CID 51171787
N-(2,3-dihydro-1H-inden-5-yl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 17403152
(2S)-2-[furan-2-ylmethyl(methyl)amino]-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]propanamide
CID 26518608
2-[2-aminoethyl(methyl)amino]-N-(furan-2-ylmethyl)propanamide
CID 61348725
N-(furan-2-ylmethyl)-2-[2-[methyl(3-methylbutyl)amino]propanoylamino]benzamide
CID 87018409

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
The IUPAC name of N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide (CID 43526612) is N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide.
What is the SMILES notation for N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
The canonical SMILES for N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide is CC(C(=O)Nc1ccccc1N)N(C)Cc1ccco1.
What is the InChIKey of N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
The InChIKey is RVPONKSVEQMWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11(18(2)10-12-6-5-9-20-12)15(19)17-14-8-4-3-7-13(14)16/h3-9,11H,10,16H2,1-2H3,(H,17,19).
What are the key properties of N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide has a molecular weight of 273.34 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide is sourced from PubChem (CID 43526612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).