6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide

C17H21N3O2S — CID 30386631

IUPAC6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cn1
InChIInChI=1S/C17H21N3O2S/c1-13-4-5-14(11-18-13)17(21)19-12-15(16-3-2-10-23-16)20-6-8-22-9-7-20/h2-5,10-11,15H,6-9,12H2,1H3,(H,19,21)/t15-/m0/s1
InChIKeyYYRYQOSONPJMLM-HNNXBMFYSA-N
MW331.44 g/mol
LogP2.25
Rot. Bonds5

About 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide

6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide (PubChem CID 30386631) has the molecular formula C17H21N3O2S and a molecular weight of 331.44 g/mol. Its IUPAC name is 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
PubChem CID30386631
Molecular FormulaC17H21N3O2S
Molecular Weight331.44 g/mol
Exact Mass331.14
IUPAC Name6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cn1
InChIInChI=1S/C17H21N3O2S/c1-13-4-5-14(11-18-13)17(21)19-12-15(16-3-2-10-23-16)20-6-8-22-9-7-20/h2-5,10-11,15H,6-9,12H2,1H3,(H,19,21)/t15-/m0/s1
InChIKeyYYRYQOSONPJMLM-HNNXBMFYSA-N
XLogP2.25
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
CID 31334942
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 47007223
5,6-dichloro-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
CID 2509986
4-(3,5-dimethylpyrazol-1-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 31404253
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-6-methylpyridine-3-carboxamide
CID 60597091
4-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 30335533
4-bromo-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
CID 52984970
4-cyano-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 17405365
3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 9094127
5-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2-oxazole-3-carboxamide
CID 93482387
6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 43050246
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-4-phenylmethoxybenzamide
CID 2510532

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide (CID 30386631) is 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide is Cc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cn1.
What is the InChIKey of 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide?
The InChIKey is YYRYQOSONPJMLM-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H21N3O2S/c1-13-4-5-14(11-18-13)17(21)19-12-15(16-3-2-10-23-16)20-6-8-22-9-7-20/h2-5,10-11,15H,6-9,12H2,1H3,(H,19,21)/t15-/m0/s1.
What are the key properties of 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide?
6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide has a molecular weight of 331.44 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide is sourced from PubChem (CID 30386631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).