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

C16H26N4O2S — CID 99788458

IUPAC(3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
SMILESCCN1CCC[C@@H](NC(=O)N2CCOC[C@@H]2c2nc(C)cs2)C1
InChIInChI=1S/C16H26N4O2S/c1-3-19-6-4-5-13(9-19)18-16(21)20-7-8-22-10-14(20)15-17-12(2)11-23-15/h11,13-14H,3-10H2,1-2H3,(H,18,21)/t13-,14-/m1/s1
InChIKeyAYNCJXQMCQPLSU-ZIAGYGMSSA-N
MW338.48 g/mol
LogP2.02
Rot. Bonds3

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

(3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide (PubChem CID 99788458) has the molecular formula C16H26N4O2S and a molecular weight of 338.48 g/mol. Its IUPAC name is (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
PubChem CID99788458
Molecular FormulaC16H26N4O2S
Molecular Weight338.48 g/mol
Exact Mass338.18
IUPAC Name(3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
SMILESCCN1CCC[C@@H](NC(=O)N2CCOC[C@@H]2c2nc(C)cs2)C1
InChIInChI=1S/C16H26N4O2S/c1-3-19-6-4-5-13(9-19)18-16(21)20-7-8-22-10-14(20)15-17-12(2)11-23-15/h11,13-14H,3-10H2,1-2H3,(H,18,21)/t13-,14-/m1/s1
InChIKeyAYNCJXQMCQPLSU-ZIAGYGMSSA-N
XLogP2.02
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.48
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-N-(2-bromoprop-2-enyl)-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 99829886
N-[1-(1-methylpyrazol-4-yl)ethyl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 131960819
(3S)-N-[(2,4-dimethylphenyl)methyl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 99829842
(3R)-N-[2-(2-methylpyrazol-3-yl)ethyl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 99830526
[3-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]-(4,5,6,7-tetrahydro-2H-benzotriazol-5-yl)methanone
CID 154779345
[(2S)-2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 95762443
2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide
CID 62800166
2-[3-(methylamino)piperidin-1-yl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 62547767
2-(4-methyl-1,3-thiazol-2-yl)-N-pyridin-4-ylpyrrolidine-1-carboxamide
CID 167816908
[1-(4-methoxyphenyl)-5-methyltriazol-4-yl]-[3-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]methanone
CID 126788583
[1-(4-methylphenyl)triazol-4-yl]-[3-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]methanone
CID 126795570
1-[2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]prop-2-en-1-one
CID 123326617

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide?
The IUPAC name of (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide (CID 99788458) is (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide?
The canonical SMILES for (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide is CCN1CCC[C@@H](NC(=O)N2CCOC[C@@H]2c2nc(C)cs2)C1.
What is the InChIKey of (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide?
The InChIKey is AYNCJXQMCQPLSU-ZIAGYGMSSA-N. The full InChI is InChI=1S/C16H26N4O2S/c1-3-19-6-4-5-13(9-19)18-16(21)20-7-8-22-10-14(20)15-17-12(2)11-23-15/h11,13-14H,3-10H2,1-2H3,(H,18,21)/t13-,14-/m1/s1.
What are the key properties of (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide?
(3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide has a molecular weight of 338.48 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(3R)-1-ethylpiperidin-3-yl]-3-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 99788458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).