(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide

C14H26N2O3 — CID 99857632

IUPAC(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide
SMILESCC[C@@]1(C)CN(C(=O)N[C@H](C)[C@@H]2CCOC2)CCO1
InChIInChI=1S/C14H26N2O3/c1-4-14(3)10-16(6-8-19-14)13(17)15-11(2)12-5-7-18-9-12/h11-12H,4-10H2,1-3H3,(H,15,17)/t11-,12-,14+/m1/s1
InChIKeyRPQRXNVGENOIIR-BZPMIXESSA-N
MW270.37 g/mol
LogP1.62
Rot. Bonds3

About (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide

(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide (PubChem CID 99857632) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide
PubChem CID99857632
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide
SMILESCC[C@@]1(C)CN(C(=O)N[C@H](C)[C@@H]2CCOC2)CCO1
InChIInChI=1S/C14H26N2O3/c1-4-14(3)10-16(6-8-19-14)13(17)15-11(2)12-5-7-18-9-12/h11-12H,4-10H2,1-3H3,(H,15,17)/t11-,12-,14+/m1/s1
InChIKeyRPQRXNVGENOIIR-BZPMIXESSA-N
XLogP1.62
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-2-methyl-N-(oxolan-3-ylmethyl)morpholine-4-carboxamide
CID 86818299
(2S)-N-[(1S)-1-cyclopropyl-2-methoxyethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99825232
(2S)-2-ethyl-2-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]propyl]morpholine-4-carboxamide
CID 129399538
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
CID 103768181
(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
CID 99789877
(3S)-1-[1-(oxolan-3-yl)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 104876966
(2S)-N-[(1R)-1-(4-cyanophenyl)ethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99857608
(2R)-2-ethyl-2-methyl-N-[(2R)-1-(1,2,4-triazol-1-yl)propan-2-yl]morpholine-4-carboxamide
CID 99857623
(2R)-N-[(1R,3S)-3-(dimethylamino)cyclopentyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 100658333
4-methyl-N-[1-(oxan-4-yl)ethyl]piperidine-1-carboxamide
CID 113258503
(2S)-2-ethyl-2-methyl-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)propyl]morpholine-4-carboxamide
CID 99857636
2-amino-N-[1-(oxolan-3-yl)ethyl]acetamide
CID 115734721

Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide?
The IUPAC name of (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide (CID 99857632) is (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide.
What is the SMILES notation for (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide?
The canonical SMILES for (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide is CC[C@@]1(C)CN(C(=O)N[C@H](C)[C@@H]2CCOC2)CCO1.
What is the InChIKey of (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide?
The InChIKey is RPQRXNVGENOIIR-BZPMIXESSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-4-14(3)10-16(6-8-19-14)13(17)15-11(2)12-5-7-18-9-12/h11-12H,4-10H2,1-3H3,(H,15,17)/t11-,12-,14+/m1/s1.
What are the key properties of (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide?
(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 99857632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).