2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide

C16H20FN5O2S — CID 154669842

IUPAC2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide
SMILESC[C@@H]1CN(c2cccc(-c3nc(NC(=O)CN)sc3F)n2)C[C@H](C)O1
InChIInChI=1S/C16H20FN5O2S/c1-9-7-22(8-10(2)24-9)12-5-3-4-11(19-12)14-15(17)25-16(21-14)20-13(23)6-18/h3-5,9-10H,6-8,18H2,1-2H3,(H,20,21,23)/t9-,10+
InChIKeyLIPKQSJUKNBMPS-AOOOYVTPSA-N
MW365.43 g/mol
LogP1.86
Rot. Bonds4

About 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide

2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide (PubChem CID 154669842) has the molecular formula C16H20FN5O2S and a molecular weight of 365.43 g/mol. Its IUPAC name is 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide
PubChem CID154669842
Molecular FormulaC16H20FN5O2S
Molecular Weight365.43 g/mol
Exact Mass365.13
IUPAC Name2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide
SMILESC[C@@H]1CN(c2cccc(-c3nc(NC(=O)CN)sc3F)n2)C[C@H](C)O1
InChIInChI=1S/C16H20FN5O2S/c1-9-7-22(8-10(2)24-9)12-5-3-4-11(19-12)14-15(17)25-16(21-14)20-13(23)6-18/h3-5,9-10H,6-8,18H2,1-2H3,(H,20,21,23)/t9-,10+
InChIKeyLIPKQSJUKNBMPS-AOOOYVTPSA-N
XLogP1.86
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide with MolForge

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Launch Full Analysis

Related Compounds

tert-butyl N-[2-[[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]amino]-2-oxoethyl]carbamate
CID 154667580
2-amino-N-[4-[3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-1,3-thiazol-2-yl]acetamide
CID 155037559
[6-(2,6-dimethylmorpholin-4-yl)-2-pyridinyl]methanamine
CID 62299451
2-amino-N-[4-[6-(2,6-dimethyloxan-4-yl)-2-pyridinyl]-1,3-thiazol-2-yl]acetamide
CID 154667723
methyl 6-(2,6-dimethylmorpholin-4-yl)pyridine-2-carboxylate
CID 123942155
(3S)-3-amino-1-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-1,3-thiazol-2-yl]-4-methoxybutan-2-one
CID 156818010
(2R,6S)-2,6-dimethyl-4-(6-methyl-2-pyridinyl)morpholine
CID 89468985
[2-[[4-[3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl] carbamate
CID 175186749
[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl] hydrogen carbonate
CID 118172748
2-[6-[6-[(2S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]isoquinolin-3-yl]acetamide
CID 176666036
N-[[2-[6-(2,6-dimethylmorpholin-4-yl)-2-pyridinyl]-1,6-naphthyridin-7-yl]methyl]-3-methylsulfanylbenzamide
CID 176665353
N-[1-[[4-[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-1,3-thiazol-2-yl]carbamoyl]cyclopropyl]-1-methylpyrrole-3-carboxamide
CID 154668520

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide (CID 154669842) is 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide is C[C@@H]1CN(c2cccc(-c3nc(NC(=O)CN)sc3F)n2)C[C@H](C)O1.
What is the InChIKey of 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide?
The InChIKey is LIPKQSJUKNBMPS-AOOOYVTPSA-N. The full InChI is InChI=1S/C16H20FN5O2S/c1-9-7-22(8-10(2)24-9)12-5-3-4-11(19-12)14-15(17)25-16(21-14)20-13(23)6-18/h3-5,9-10H,6-8,18H2,1-2H3,(H,20,21,23)/t9-,10+.
What are the key properties of 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide?
2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide has a molecular weight of 365.43 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-5-fluoro-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 154669842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).