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

C13H23N3O2 — CID 62641023

IUPAC2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide
SMILESCCN(C)CCNC(C)C(=O)NCc1ccco1
InChIInChI=1S/C13H23N3O2/c1-4-16(3)8-7-14-11(2)13(17)15-10-12-6-5-9-18-12/h5-6,9,11,14H,4,7-8,10H2,1-3H3,(H,15,17)
InChIKeyDXHNIHOXKJYMRL-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.83
Rot. Bonds8

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

2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide (PubChem CID 62641023) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide
PubChem CID62641023
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide
SMILESCCN(C)CCNC(C)C(=O)NCc1ccco1
InChIInChI=1S/C13H23N3O2/c1-4-16(3)8-7-14-11(2)13(17)15-10-12-6-5-9-18-12/h5-6,9,11,14H,4,7-8,10H2,1-3H3,(H,15,17)
InChIKeyDXHNIHOXKJYMRL-UHFFFAOYSA-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

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Related Compounds

N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide
CID 62639953
(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
CID 7437364
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
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
N-(furan-2-ylmethyl)-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide
CID 43401459
N-(furan-2-ylmethyl)-2-(3-propoxypropylamino)propanamide
CID 82943073
N-[2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]ethyl]cyclopropanecarboxamide
CID 115574214
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(furan-2-ylmethyl)propanamide
CID 78915193
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
N-(furan-2-ylmethyl)-2-[(4-methylphenyl)methylamino]propanamide
CID 43084593

Frequently Asked Questions

What is the IUPAC name of 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide (CID 62641023) is 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide is CCN(C)CCNC(C)C(=O)NCc1ccco1.
What is the InChIKey of 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is DXHNIHOXKJYMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-4-16(3)8-7-14-11(2)13(17)15-10-12-6-5-9-18-12/h5-6,9,11,14H,4,7-8,10H2,1-3H3,(H,15,17).
What are the key properties of 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide?
2-[2-[ethyl(methyl)amino]ethylamino]-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 2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 62641023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).