methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate

C16H23NO4 — CID 97159681

IUPACmethyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate
SMILESCOC(=O)C[C@@H]1CN(Cc2ccc([C@H]3C[C@H]3C)o2)CCO1
InChIInChI=1S/C16H23NO4/c1-11-7-14(11)15-4-3-12(21-15)9-17-5-6-20-13(10-17)8-16(18)19-2/h3-4,11,13-14H,5-10H2,1-2H3/t11-,13-,14+/m1/s1
InChIKeyNROOKWSTFLBBCM-BNOWGMLFSA-N
MW293.36 g/mol
LogP2.17
Rot. Bonds5

About methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate

methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate (PubChem CID 97159681) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate
PubChem CID97159681
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC Namemethyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate
SMILESCOC(=O)C[C@@H]1CN(Cc2ccc([C@H]3C[C@H]3C)o2)CCO1
InChIInChI=1S/C16H23NO4/c1-11-7-14(11)15-4-3-12(21-15)9-17-5-6-20-13(10-17)8-16(18)19-2/h3-4,11,13-14H,5-10H2,1-2H3/t11-,13-,14+/m1/s1
InChIKeyNROOKWSTFLBBCM-BNOWGMLFSA-N
XLogP2.17
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate with MolForge

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Related Compounds

methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate
CID 79827347
methyl 2-[4-[(3-methylphenyl)methyl]morpholin-2-yl]acetate
CID 79822269
2-[1-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]azetidin-3-yl]acetic acid
CID 65069383
2-(methoxymethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]morpholine-4-carboxamide
CID 75374769
methyl 2-[4-[(3-bromophenyl)methyl]morpholin-2-yl]acetate
CID 79822600
methyl 3-[5-(2-methylcyclopropyl)furan-2-yl]propanoate
CID 112723028
methyl 2-[(2R)-4-[(2-chlorophenyl)methyl]morpholin-2-yl]acetate
CID 97062552
methyl 2-[4-[(2,5-dimethylphenyl)methyl]morpholin-2-yl]acetate
CID 79822519
1-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxylic acid
CID 65056448
methyl 2-[4-[(3-bromo-2,6-difluorophenyl)methyl]morpholin-2-yl]acetate
CID 106270408
methyl 2-[4-(1,2-oxazol-4-ylmethyl)morpholin-2-yl]acetate
CID 115537759
N-methyl-1-[1-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pyrrolidin-3-yl]methanamine
CID 55168091

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate?
The IUPAC name of methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate (CID 97159681) is methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate.
What is the SMILES notation for methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate?
The canonical SMILES for methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate is COC(=O)C[C@@H]1CN(Cc2ccc([C@H]3C[C@H]3C)o2)CCO1.
What is the InChIKey of methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate?
The InChIKey is NROOKWSTFLBBCM-BNOWGMLFSA-N. The full InChI is InChI=1S/C16H23NO4/c1-11-7-14(11)15-4-3-12(21-15)9-17-5-6-20-13(10-17)8-16(18)19-2/h3-4,11,13-14H,5-10H2,1-2H3/t11-,13-,14+/m1/s1.
What are the key properties of methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate?
methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate has a molecular weight of 293.36 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate is sourced from PubChem (CID 97159681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).