Nirmatrelvir Impurity 5

CAT: 1299-RM-N070005-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-N070005-01Size:10 mg

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CAS Number

2628280-47-5

Synonyms

(S) -2-amino-3- ((S) -2-oxopyrrolidin-3-yl) propanamide

Molecular Formula

C7H13N3O2

Molecular Weight

171.2

Target Alternative Name

Nirmatrelvir

Product Name Synonym

(S) -2-amino-3- ((S) -2-oxopyrrolidin-3-yl) propanamide

Chemical Information

(S)-2-Amino-3-((S)-2-oxopyrrolidin-3-yl)propanamide

CAS Number	2628280-47-5
PubChem CID	157400355
IUPAC Name	(2S)-2-amino-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide
Molecular Formula	C7H13N3O2
Molecular Weight	171.20
XLogP	-2
Topological Polar Surface Area	98.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	205

SMILES

C1CNC(=O)[C@@H]1C[C@@H](C(=O)N)N

InChI

InChI=1S/C7H13N3O2/c8-5(6(9)11)3-4-1-2-10-7(4)12/h4-5H,1-3,8H2,(H2,9,11)(H,10,12)/t4-,5-/m0/s1

InChIKey

GZXSWPJYQCXXED-WHFBIAKZSA-N

Chemical Structure

2D Structure

CAS: 2628280-47-5

CID: 157400355

Formula: C7H13N3O2

MW: 171.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	171.20
XLogP3	-2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	171.100776666
Monoisotopic Mass	171.100776666
Topological Polar Surface Area	98.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	205
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-G271005-01	Gc376 Impurity 5; Nirmatrelvir Impurity
RG-A260270-01	Nirmatrelvir Impurity A
RM-N070007-01	Nirmatrelvir Impurity 7
RM-N070022-01	Nirmatrelvir Impurity 22
RM-N070084-01	Nirmatrelvir Impurity 84
RM-N070083-01	Nirmatrelvir Impurity 83
RM-N070013-01	Nirmatrelvir Impurity 13
RM-N070011-01	Nirmatrelvir Impurity 11
RM-N070044-01	Nirmatrelvir Impurity 44
RM-N070035-01	Nirmatrelvir Impurity 35