3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide

C17H19ClN2O3 — CID 16809743

IUPAC3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
SMILESO=C(NCC(c1ccco1)N1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C17H19ClN2O3/c18-14-4-1-3-13(11-14)17(21)19-12-15(16-5-2-8-23-16)20-6-9-22-10-7-20/h1-5,8,11,15H,6-7,9-10,12H2,(H,19,21)
InChIKeyIDNLWYNPUAYFTH-UHFFFAOYSA-N
MW334.80 g/mol
LogP2.74
Rot. Bonds5

About 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide

3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide (PubChem CID 16809743) has the molecular formula C17H19ClN2O3 and a molecular weight of 334.80 g/mol. Its IUPAC name is 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
PubChem CID16809743
Molecular FormulaC17H19ClN2O3
Molecular Weight334.80 g/mol
Exact Mass334.11
IUPAC Name3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
SMILESO=C(NCC(c1ccco1)N1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C17H19ClN2O3/c18-14-4-1-3-13(11-14)17(21)19-12-15(16-5-2-8-23-16)20-6-9-22-10-7-20/h1-5,8,11,15H,6-7,9-10,12H2,(H,19,21)
InChIKeyIDNLWYNPUAYFTH-UHFFFAOYSA-N
XLogP2.74
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.80
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbenzamide;hydrochloride
CID 52984760
N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-nitrobenzamide
CID 7217179
N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-1,3-benzodioxole-5-carboxamide
CID 7217379
3-chloro-N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 112506584
4-chloro-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 4877480
5-chloro-N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methyl-1-benzofuran-2-carboxamide
CID 29105864
3-bromo-5-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 110621303
3,4-dichloro-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 7972696
5-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methyl-1-benzofuran-2-carboxamide;hydrochloride
CID 52985339
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 110621275
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-methylbenzamide
CID 26834257
4-chloro-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 40844556

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide?
The IUPAC name of 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide (CID 16809743) is 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide.
What is the SMILES notation for 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide?
The canonical SMILES for 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide is O=C(NCC(c1ccco1)N1CCOCC1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide?
The InChIKey is IDNLWYNPUAYFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3/c18-14-4-1-3-13(11-14)17(21)19-12-15(16-5-2-8-23-16)20-6-9-22-10-7-20/h1-5,8,11,15H,6-7,9-10,12H2,(H,19,21).
What are the key properties of 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide?
3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide has a molecular weight of 334.80 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide is sourced from PubChem (CID 16809743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).