3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide

C15H19N3O2 — CID 61250548

IUPAC3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide
SMILESCN(C)C(CNC(=O)c1cccc(N)c1)c1ccco1
InChIInChI=1S/C15H19N3O2/c1-18(2)13(14-7-4-8-20-14)10-17-15(19)11-5-3-6-12(16)9-11/h3-9,13H,10,16H2,1-2H3,(H,17,19)
InChIKeyZQSLKUHLCBEPJZ-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.89
Rot. Bonds5

About 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide

3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide (PubChem CID 61250548) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide
PubChem CID61250548
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide
SMILESCN(C)C(CNC(=O)c1cccc(N)c1)c1ccco1
InChIInChI=1S/C15H19N3O2/c1-18(2)13(14-7-4-8-20-14)10-17-15(19)11-5-3-6-12(16)9-11/h3-9,13H,10,16H2,1-2H3,(H,17,19)
InChIKeyZQSLKUHLCBEPJZ-UHFFFAOYSA-N
XLogP1.89
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 ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-iodobenzamide
CID 51145107
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide;hydrochloride
CID 20994951
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(trifluoromethyl)benzamide
CID 4803620
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-iodobenzamide
CID 51145105
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-fluorobenzamide;hydrochloride
CID 52985207
2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide
CID 46604974
3-(benzylsulfamoyl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide
CID 24981861
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-[6-(ethylamino)pyridazin-3-yl]benzamide
CID 125447810
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-[6-(ethylamino)pyridazin-3-yl]benzamide
CID 122571839
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-piperidin-1-ylsulfonylbenzamide
CID 55332159
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-ethoxy-3-methoxybenzamide
CID 51162709
2-bromo-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-methylbenzamide
CID 103852810

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide?
The IUPAC name of 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide (CID 61250548) is 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide.
What is the SMILES notation for 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide?
The canonical SMILES for 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide is CN(C)C(CNC(=O)c1cccc(N)c1)c1ccco1.
What is the InChIKey of 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide?
The InChIKey is ZQSLKUHLCBEPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-18(2)13(14-7-4-8-20-14)10-17-15(19)11-5-3-6-12(16)9-11/h3-9,13H,10,16H2,1-2H3,(H,17,19).
What are the key properties of 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide?
3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide has a molecular weight of 273.34 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide is sourced from PubChem (CID 61250548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).