(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide

C13H23N3O2 — CID 7437364

IUPAC(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
SMILESC[C@@H](NCCCN(C)C)C(=O)NCc1ccco1
InChIInChI=1S/C13H23N3O2/c1-11(14-7-5-8-16(2)3)13(17)15-10-12-6-4-9-18-12/h4,6,9,11,14H,5,7-8,10H2,1-3H3,(H,15,17)/t11-/m1/s1
InChIKeyXFPCWFNVCHLWNJ-LLVKDONJSA-N
MW253.35 g/mol
LogP0.83
Rot. Bonds8

About (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide

(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide (PubChem CID 7437364) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
PubChem CID7437364
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
SMILESC[C@@H](NCCCN(C)C)C(=O)NCc1ccco1
InChIInChI=1S/C13H23N3O2/c1-11(14-7-5-8-16(2)3)13(17)15-10-12-6-4-9-18-12/h4,6,9,11,14H,5,7-8,10H2,1-3H3,(H,15,17)/t11-/m1/s1
InChIKeyXFPCWFNVCHLWNJ-LLVKDONJSA-N
XLogP0.83
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)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-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide
CID 62639953
2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide
CID 62641023
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
N-(furan-2-ylmethyl)-2-(3-propoxypropylamino)propanamide
CID 82943073
2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466208
2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(furan-2-ylmethyl)propanamide
CID 54940460
2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-N-(furan-2-ylmethyl)propanamide
CID 106147403
2-[1-(dimethylamino)propan-2-ylamino]-N-(furan-2-ylmethyl)propanamide
CID 82938141
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(furan-2-ylmethyl)propanamide
CID 78915193
N-[2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]ethyl]cyclopropanecarboxamide
CID 115574214
N-(furan-2-ylmethyl)-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide
CID 43401459
2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide
CID 43086708

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide (CID 7437364) is (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide is C[C@@H](NCCCN(C)C)C(=O)NCc1ccco1.
What is the InChIKey of (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is XFPCWFNVCHLWNJ-LLVKDONJSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-11(14-7-5-8-16(2)3)13(17)15-10-12-6-4-9-18-12/h4,6,9,11,14H,5,7-8,10H2,1-3H3,(H,15,17)/t11-/m1/s1.
What are the key properties of (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide?
(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 253.35 g/mol, XLogP of 0.83, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 7437364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).