2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide

C16H19NO4 — CID 31001904

IUPAC2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide
SMILESCOc1ccccc1OCC(=O)N[C@@H](C)c1ccc(C)o1
InChIInChI=1S/C16H19NO4/c1-11-8-9-13(21-11)12(2)17-16(18)10-20-15-7-5-4-6-14(15)19-3/h4-9,12H,10H2,1-3H3,(H,17,18)/t12-/m0/s1
InChIKeyLTSIHOFPCKHCFC-LBPRGKRZSA-N
MW289.33 g/mol
LogP2.85
Rot. Bonds6

About 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide

2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide (PubChem CID 31001904) has the molecular formula C16H19NO4 and a molecular weight of 289.33 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide
PubChem CID31001904
Molecular FormulaC16H19NO4
Molecular Weight289.33 g/mol
Exact Mass289.13
IUPAC Name2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide
SMILESCOc1ccccc1OCC(=O)N[C@@H](C)c1ccc(C)o1
InChIInChI=1S/C16H19NO4/c1-11-8-9-13(21-11)12(2)17-16(18)10-20-15-7-5-4-6-14(15)19-3/h4-9,12H,10H2,1-3H3,(H,17,18)/t12-/m0/s1
InChIKeyLTSIHOFPCKHCFC-LBPRGKRZSA-N
XLogP2.85
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
CID 51187818
N-[1-(5-methylfuran-2-yl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 51187811
methyl (2R)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoate
CID 113257879
N-[1-(2-bromophenyl)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 16548373
N-[(2R)-1-hydroxypropan-2-yl]-2-(2-methoxyphenoxy)acetamide
CID 39086763
(2S)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 746811
2-(2-methoxyphenoxy)-N-pentan-2-ylacetamide
CID 2957379
(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide
CID 8750931
methyl 3-(2-methoxyphenoxy)-2-(5-methylfuran-2-yl)propanoate
CID 117240986
3,4-dimethoxy-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 46494747
2-(2-methoxyphenoxy)-N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 2608512
[2-[1-(2-methoxyphenyl)ethylamino]-2-oxoethyl] 2-(2-methoxyphenoxy)acetate
CID 55366842

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide (CID 31001904) is 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide is COc1ccccc1OCC(=O)N[C@@H](C)c1ccc(C)o1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide?
The InChIKey is LTSIHOFPCKHCFC-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H19NO4/c1-11-8-9-13(21-11)12(2)17-16(18)10-20-15-7-5-4-6-14(15)19-3/h4-9,12H,10H2,1-3H3,(H,17,18)/t12-/m0/s1.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide?
2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide has a molecular weight of 289.33 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide is sourced from PubChem (CID 31001904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).