N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide

C12H18N2O3 — CID 66429169

IUPACN-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide
SMILESCc1ccc(CNC(=O)CC2CNCCO2)o1
InChIInChI=1S/C12H18N2O3/c1-9-2-3-10(17-9)8-14-12(15)6-11-7-13-4-5-16-11/h2-3,11,13H,4-8H2,1H3,(H,14,15)
InChIKeyJLJHMCKOYVGTNT-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.58
Rot. Bonds4

About N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide

N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide (PubChem CID 66429169) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide
PubChem CID66429169
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide
SMILESCc1ccc(CNC(=O)CC2CNCCO2)o1
InChIInChI=1S/C12H18N2O3/c1-9-2-3-10(17-9)8-14-12(15)6-11-7-13-4-5-16-11/h2-3,11,13H,4-8H2,1H3,(H,14,15)
InChIKeyJLJHMCKOYVGTNT-UHFFFAOYSA-N
XLogP0.58
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-2-[(2R)-morpholin-2-yl]acetamide
CID 125163130
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-2-morpholin-2-ylacetamide
CID 118763783
N-[(4-methoxyphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66434532
N-[(5-ethylthiophen-2-yl)methyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119727879
N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
CID 114332328
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-morpholin-2-ylacetamide
CID 66429190
N-methyl-N-[2-(5-methylfuran-2-yl)ethyl]-2-morpholin-2-ylacetamide
CID 115178233
2-morpholin-2-yl-N-[(4-nitrophenyl)methyl]acetamide
CID 66426771
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-morpholin-2-ylacetamide
CID 79236981
2-morpholin-2-yl-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 81170232
N-[(2,2-dimethylcyclopropyl)methyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119785418
N-[(5-bromothiophen-2-yl)methyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119730032

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide (CID 66429169) is N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide is Cc1ccc(CNC(=O)CC2CNCCO2)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide?
The InChIKey is JLJHMCKOYVGTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-9-2-3-10(17-9)8-14-12(15)6-11-7-13-4-5-16-11/h2-3,11,13H,4-8H2,1H3,(H,14,15).
What are the key properties of N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide?
N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide has a molecular weight of 238.29 g/mol, XLogP of 0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66429169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).