N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide

C17H20N2O4 — CID 18118956

IUPACN-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C17H20N2O4/c1-2-9-22-14-7-5-13(6-8-14)17(21)19-12-16(20)18-11-15-4-3-10-23-15/h3-8,10H,2,9,11-12H2,1H3,(H,18,20)(H,19,21)
InChIKeyFOZZIQXQQPAXRB-UHFFFAOYSA-N
MW316.36 g/mol
LogP2.11
Rot. Bonds8

About N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide

N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide (PubChem CID 18118956) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide.

Molecular Properties

Compound NameN-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide
PubChem CID18118956
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC NameN-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C17H20N2O4/c1-2-9-22-14-7-5-13(6-8-14)17(21)19-12-16(20)18-11-15-4-3-10-23-15/h3-8,10H,2,9,11-12H2,1H3,(H,18,20)(H,19,21)
InChIKeyFOZZIQXQQPAXRB-UHFFFAOYSA-N
XLogP2.11
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-4-heptoxybenzamide
CID 3131904
N-(furan-2-ylmethyl)-4-(2-methoxyethoxy)benzamide
CID 15943207
4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 17395333
4-[[2-(4-butoxyanilino)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54820132
N-(furan-2-ylmethyl)-4-[(4-propoxybenzoyl)carbamothioylamino]benzamide
CID 28638586
2-[[2-(4-acetylphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 30039326
N-(furan-2-ylmethyl)-2-(4-heptoxyanilino)acetamide
CID 54821868
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 9079933
N-(furan-2-ylmethyl)-4-[[2-[4-(2-methoxyethoxy)anilino]acetyl]amino]benzamide
CID 54822273
N-(furan-2-ylmethylcarbamothioyl)-4-hexoxybenzamide
CID 4934073
N-(furan-2-ylmethylcarbamothioyl)-4-heptoxybenzamide
CID 4950958
4-(dimethylsulfamoyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 18118985

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide?
The IUPAC name of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide (CID 18118956) is N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide.
What is the SMILES notation for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide?
The canonical SMILES for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide is CCCOc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1.
What is the InChIKey of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide?
The InChIKey is FOZZIQXQQPAXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-2-9-22-14-7-5-13(6-8-14)17(21)19-12-16(20)18-11-15-4-3-10-23-15/h3-8,10H,2,9,11-12H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide?
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide has a molecular weight of 316.36 g/mol, XLogP of 2.11, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide is sourced from PubChem (CID 18118956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).