(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide

C14H23N3O2S — CID 99789877

IUPAC(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
SMILESCC[C@]1(C)CN(C(=O)N[C@@H](C)c2ncc(C)s2)CCO1
InChIInChI=1S/C14H23N3O2S/c1-5-14(4)9-17(6-7-19-14)13(18)16-11(3)12-15-8-10(2)20-12/h8,11H,5-7,9H2,1-4H3,(H,16,18)/t11-,14+/m0/s1
InChIKeyYDBAMGZNJWOHGJ-SMDDNHRTSA-N
MW297.42 g/mol
LogP2.72
Rot. Bonds3

About (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide

(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide (PubChem CID 99789877) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
PubChem CID99789877
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
SMILESCC[C@]1(C)CN(C(=O)N[C@@H](C)c2ncc(C)s2)CCO1
InChIInChI=1S/C14H23N3O2S/c1-5-14(4)9-17(6-7-19-14)13(18)16-11(3)12-15-8-10(2)20-12/h8,11H,5-7,9H2,1-4H3,(H,16,18)/t11-,14+/m0/s1
InChIKeyYDBAMGZNJWOHGJ-SMDDNHRTSA-N
XLogP2.72
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99830093
(2S)-N-[(1R)-1-(4-cyanophenyl)ethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99857608
3-ethyl-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]-4-oxoimidazolidine-1-carboxamide
CID 119048114
(2S)-2-benzyl-N-[(1R)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
CID 99819549
(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide
CID 99857632
3-hydroxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]piperidine-1-carboxamide
CID 111841012
(2R)-2-ethyl-2-methyl-N-[(2R)-1-(1,2,4-triazol-1-yl)propan-2-yl]morpholine-4-carboxamide
CID 99857623
(2S)-2-ethyl-2-methyl-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)propyl]morpholine-4-carboxamide
CID 99857636
4-(3-ethyl-1,2,4-thiadiazol-5-yl)-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]piperazine-1-carboxamide
CID 136512975
(2R)-2-ethyl-N-[(1S)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]-2-methylmorpholine-4-carboxamide
CID 99831196
2-methyl-1-[1-(5-methyl-1,3-thiazol-2-yl)ethylcarbamoyl]piperidine-2-carboxylic acid
CID 104598427
(2S)-N-[(1S)-1-cyclopropyl-2-methoxyethyl]-2-ethyl-2-methylmorpholine-4-carboxamide
CID 99825232

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide?
The IUPAC name of (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide (CID 99789877) is (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide is CC[C@]1(C)CN(C(=O)N[C@@H](C)c2ncc(C)s2)CCO1.
What is the InChIKey of (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide?
The InChIKey is YDBAMGZNJWOHGJ-SMDDNHRTSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-5-14(4)9-17(6-7-19-14)13(18)16-11(3)12-15-8-10(2)20-12/h8,11H,5-7,9H2,1-4H3,(H,16,18)/t11-,14+/m0/s1.
What are the key properties of (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide?
(2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide has a molecular weight of 297.42 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-2-methyl-N-[(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 99789877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).