N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide

C18H21N3O4 — CID 54834688

IUPACN-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide
SMILESO=C(NCc1ccco1)c1cccc(NCC(=O)N2CCOCC2)c1
InChIInChI=1S/C18H21N3O4/c22-17(21-6-9-24-10-7-21)13-19-15-4-1-3-14(11-15)18(23)20-12-16-5-2-8-25-16/h1-5,8,11,19H,6-7,9-10,12-13H2,(H,20,23)
InChIKeyYWROYZDLOODAOW-UHFFFAOYSA-N
MW343.38 g/mol
LogP1.48
Rot. Bonds6

About N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide

N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide (PubChem CID 54834688) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide
PubChem CID54834688
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide
SMILESO=C(NCc1ccco1)c1cccc(NCC(=O)N2CCOCC2)c1
InChIInChI=1S/C18H21N3O4/c22-17(21-6-9-24-10-7-21)13-19-15-4-1-3-14(11-15)18(23)20-12-16-5-2-8-25-16/h1-5,8,11,19H,6-7,9-10,12-13H2,(H,20,23)
InChIKeyYWROYZDLOODAOW-UHFFFAOYSA-N
XLogP1.48
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-3-[[2-[4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]amino]benzamide
CID 54834364
3-[[2-(tert-butylamino)-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834747
N-(furan-2-ylmethyl)-3-[[2-oxo-2-[3-(pyrrolidine-1-carbonyl)anilino]ethyl]amino]benzamide
CID 54834609
N-(furan-2-ylmethyl)-3-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54841123
3-[[2-[3-(furan-2-ylmethylcarbamoyl)anilino]acetyl]amino]benzamide
CID 54834582
3-[[2-(diethylamino)-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834716
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
3-[[[amino(morpholin-4-yl)methylidene]amino]methyl]-N-(furan-2-ylmethyl)benzamide
CID 75532942
3-[[2-[3-(furan-2-ylmethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-methylbenzamide
CID 54839990
N-(furan-2-ylmethyl)-3-[[2-(3-methylanilino)acetyl]amino]benzamide
CID 54810881
N-(furan-2-ylmethyl)-3-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 54834687
3-[[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834396

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide (CID 54834688) is N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide is O=C(NCc1ccco1)c1cccc(NCC(=O)N2CCOCC2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide?
The InChIKey is YWROYZDLOODAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c22-17(21-6-9-24-10-7-21)13-19-15-4-1-3-14(11-15)18(23)20-12-16-5-2-8-25-16/h1-5,8,11,19H,6-7,9-10,12-13H2,(H,20,23).
What are the key properties of N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide?
N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide has a molecular weight of 343.38 g/mol, XLogP of 1.48, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-[(2-morpholin-4-yl-2-oxoethyl)amino]benzamide is sourced from PubChem (CID 54834688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).