2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide

C16H25N3O3S — CID 92631947

IUPAC2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide
SMILESCOCC(=O)NCC[C@H]1CCCCN1C(=O)Cc1csc(C)n1
InChIInChI=1S/C16H25N3O3S/c1-12-18-13(11-23-12)9-16(21)19-8-4-3-5-14(19)6-7-17-15(20)10-22-2/h11,14H,3-10H2,1-2H3,(H,17,20)/t14-/m1/s1
InChIKeyHGUDTEGKDDIZQE-CQSZACIVSA-N
MW339.46 g/mol
LogP1.53
Rot. Bonds7

About 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide

2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide (PubChem CID 92631947) has the molecular formula C16H25N3O3S and a molecular weight of 339.46 g/mol. Its IUPAC name is 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide
PubChem CID92631947
Molecular FormulaC16H25N3O3S
Molecular Weight339.46 g/mol
Exact Mass339.16
IUPAC Name2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide
SMILESCOCC(=O)NCC[C@H]1CCCCN1C(=O)Cc1csc(C)n1
InChIInChI=1S/C16H25N3O3S/c1-12-18-13(11-23-12)9-16(21)19-8-4-3-5-14(19)6-7-17-15(20)10-22-2/h11,14H,3-10H2,1-2H3,(H,17,20)/t14-/m1/s1
InChIKeyHGUDTEGKDDIZQE-CQSZACIVSA-N
XLogP1.53
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-[(2S)-2-[2-(dimethylsulfamoylamino)ethyl]piperidin-1-yl]-2-oxoethyl]-2-methyl-1,3-thiazole
CID 92634264
methyl (2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidine-2-carboxylate
CID 79833335
2-(2-methyl-1,3-thiazol-4-yl)-1-[2-(pyrazol-1-ylmethyl)piperidin-1-yl]ethanone
CID 56778842
1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidine-2-carboxylic acid
CID 43355974
ethyl 1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidine-2-carboxylate
CID 78915899
1-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 56779489
2-(2-methyl-1,3-thiazol-4-yl)-1-[(2R)-2-pyrazolo[1,5-a]pyrimidin-5-ylpiperidin-1-yl]ethanone
CID 125004350
3-[1-[2-(2-amino-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]propanoic acid
CID 62800180
N-cyclopropyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
CID 47164618
2-(2-methyl-1,3-thiazol-4-yl)-N-(2-piperidin-1-ylethyl)acetamide
CID 143940582
2-(2-methyl-1,3-thiazol-4-yl)-1-[(2R)-2-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 95845730
2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide
CID 92631951

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide?
The IUPAC name of 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide (CID 92631947) is 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide?
The canonical SMILES for 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide is COCC(=O)NCC[C@H]1CCCCN1C(=O)Cc1csc(C)n1.
What is the InChIKey of 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide?
The InChIKey is HGUDTEGKDDIZQE-CQSZACIVSA-N. The full InChI is InChI=1S/C16H25N3O3S/c1-12-18-13(11-23-12)9-16(21)19-8-4-3-5-14(19)6-7-17-15(20)10-22-2/h11,14H,3-10H2,1-2H3,(H,17,20)/t14-/m1/s1.
What are the key properties of 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide?
2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide has a molecular weight of 339.46 g/mol, XLogP of 1.53, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide is sourced from PubChem (CID 92631947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).