(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide

C11H9F2N3OS — CID 175993315

IUPAC(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide
SMILESN[C@@H](C(=O)Nc1nccs1)c1cc(F)ccc1F
InChIInChI=1S/C11H9F2N3OS/c12-6-1-2-8(13)7(5-6)9(14)10(17)16-11-15-3-4-18-11/h1-5,9H,14H2,(H,15,16,17)/t9-/m1/s1
InChIKeyMFLODHQOEWPMAQ-SECBINFHSA-N
MW269.28 g/mol
LogP2.06
Rot. Bonds3

About (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide

(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 175993315) has the molecular formula C11H9F2N3OS and a molecular weight of 269.28 g/mol. Its IUPAC name is (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID175993315
Molecular FormulaC11H9F2N3OS
Molecular Weight269.28 g/mol
Exact Mass269.04
IUPAC Name(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide
SMILESN[C@@H](C(=O)Nc1nccs1)c1cc(F)ccc1F
InChIInChI=1S/C11H9F2N3OS/c12-6-1-2-8(13)7(5-6)9(14)10(17)16-11-15-3-4-18-11/h1-5,9H,14H2,(H,15,16,17)/t9-/m1/s1
InChIKeyMFLODHQOEWPMAQ-SECBINFHSA-N
XLogP2.06
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[1-(2,5-difluorophenyl)-2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]carbamate
CID 146468890
2-(2,4-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 110488848
1-[(2S)-2-(2,4-difluorophenyl)-2-hydroxyethyl]-3-(1,3-thiazol-2-yl)urea
CID 94024696
2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide
CID 116849798
1-[2-(2,5-difluorophenyl)-2-hydroxyethyl]-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 71889221
(2R)-2-[5-[2-(6-amino-3-pyridinyl)ethynyl]-3-oxo-1H-isoindol-2-yl]-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 175748518
1-[2-(2,4-difluorophenyl)sulfanylphenyl]-3-(1,3-thiazol-2-yl)urea
CID 59732885
methyl (2S)-2-amino-2-(2,5-difluorophenyl)acetate
CID 51888842
2-(5-fluoro-2-hydroxyphenyl)-2-[(2-iodophenyl)methylamino]-N-(1,3-thiazol-2-yl)acetamide
CID 170794718
2-amino-N-(1,3-thiazol-2-yl)butanamide
CID 43649283
(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide
CID 46226333
1-[1-(2,4-difluorophenyl)ethyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 47068763

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide (CID 175993315) is (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide is N[C@@H](C(=O)Nc1nccs1)c1cc(F)ccc1F.
What is the InChIKey of (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is MFLODHQOEWPMAQ-SECBINFHSA-N. The full InChI is InChI=1S/C11H9F2N3OS/c12-6-1-2-8(13)7(5-6)9(14)10(17)16-11-15-3-4-18-11/h1-5,9H,14H2,(H,15,16,17)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide?
(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 269.28 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 175993315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).