(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide

C16H26N2O4 — CID 99831196

IUPAC(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide
SMILESCC[C@]1(C)CN(C(=O)N[C@@H](COC)c2ccc(C)o2)CCO1
InChIInChI=1S/C16H26N2O4/c1-5-16(3)11-18(8-9-21-16)15(19)17-13(10-20-4)14-7-6-12(2)22-14/h6-7,13H,5,8-11H2,1-4H3,(H,17,19)/t13-,16+/m0/s1
InChIKeyMWAYTKJOPUJCKF-XJKSGUPXSA-N
MW310.39 g/mol
LogP2.49
Rot. Bonds5

About (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide

(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide (PubChem CID 99831196) has the molecular formula C16H26N2O4 and a molecular weight of 310.39 g/mol. Its IUPAC name is (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide
PubChem CID99831196
Molecular FormulaC16H26N2O4
Molecular Weight310.39 g/mol
Exact Mass310.19
IUPAC Name(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide
SMILESCC[C@]1(C)CN(C(=O)N[C@@H](COC)c2ccc(C)o2)CCO1
InChIInChI=1S/C16H26N2O4/c1-5-16(3)11-18(8-9-21-16)15(19)17-13(10-20-4)14-7-6-12(2)22-14/h6-7,13H,5,8-11H2,1-4H3,(H,17,19)/t13-,16+/m0/s1
InChIKeyMWAYTKJOPUJCKF-XJKSGUPXSA-N
XLogP2.49
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[(1S)-1-cyclopropyl-2-methoxyethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99825232
1-[[3-methoxy-1-(5-methylfuran-2-yl)propyl]carbamoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 122009381
N-[(1R)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-4-(1-methylpyrazol-4-yl)piperazine-1-carboxamide
CID 124608580
(2S)-2-ethyl-2-methyl-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)propyl]morpholine-4-carboxamide
CID 99857636
(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
CID 99789877
(2S)-N-[(1R)-1-(4-cyanophenyl)ethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99857608
2-[[2-methoxy-1-(5-methylfuran-2-yl)ethyl]amino]-1-piperidin-1-ylethanone
CID 75504575
(2S)-2-ethyl-N-[[3-(methoxymethyl)phenyl]methyl]-2-methylmorpholine-4-carboxamide
CID 99824406
(3S)-N-[(1R)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-(1,3-thiazol-2-yl)piperidine-1-carboxamide
CID 124608574
(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99830093
4-[[2-methoxy-1-(5-methylfuran-2-yl)ethyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120673694
1-[[1-(5-ethylfuran-2-yl)-2-methoxyethyl]carbamoyl]piperidine-3-carboxylic acid
CID 122003589

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide?
The IUPAC name of (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide (CID 99831196) is (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide?
The canonical SMILES for (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide is CC[C@]1(C)CN(C(=O)N[C@@H](COC)c2ccc(C)o2)CCO1.
What is the InChIKey of (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide?
The InChIKey is MWAYTKJOPUJCKF-XJKSGUPXSA-N. The full InChI is InChI=1S/C16H26N2O4/c1-5-16(3)11-18(8-9-21-16)15(19)17-13(10-20-4)14-7-6-12(2)22-14/h6-7,13H,5,8-11H2,1-4H3,(H,17,19)/t13-,16+/m0/s1.
What are the key properties of (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide?
(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide has a molecular weight of 310.39 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide is sourced from PubChem (CID 99831196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).