(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide

C6H10N4O3 — CID 137184745

IUPAC(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide
SMILESC[C@@H](N)C(=O)NCc1noc(=O)[nH]1
InChIInChI=1S/C6H10N4O3/c1-3(7)5(11)8-2-4-9-6(12)13-10-4/h3H,2,7H2,1H3,(H,8,11)(H,9,10,12)/t3-/m1/s1
InChIKeyBPLOXHVICFMWAD-GSVOUGTGSA-N
MW186.17 g/mol
LogP-1.67
Rot. Bonds3

About (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide

(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide (PubChem CID 137184745) has the molecular formula C6H10N4O3 and a molecular weight of 186.17 g/mol. Its IUPAC name is (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide
PubChem CID137184745
Molecular FormulaC6H10N4O3
Molecular Weight186.17 g/mol
Exact Mass186.08
IUPAC Name(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide
SMILESC[C@@H](N)C(=O)NCc1noc(=O)[nH]1
InChIInChI=1S/C6H10N4O3/c1-3(7)5(11)8-2-4-9-6(12)13-10-4/h3H,2,7H2,1H3,(H,8,11)(H,9,10,12)/t3-/m1/s1
InChIKeyBPLOXHVICFMWAD-GSVOUGTGSA-N
XLogP-1.67
TPSA114.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 5-1.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide with MolForge

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Related Compounds

3-[(propan-2-ylamino)methyl]-4H-1,2,4-oxadiazol-5-one
CID 136197517
5-oxo-N-propan-2-yl-4H-1,2,4-oxadiazole-3-carboxamide
CID 137225636
2-[(2-amino-2-hydroxyiminoethyl)amino]-N-methylpropanamide
CID 77031454
2-[(2-amino-2-hydroxyiminoethyl)amino]-N-ethylpropanamide
CID 77032674
N-(2-methylcyclopropyl)-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137181222
(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide;hydrochloride
CID 137184744
N-[(1R)-1-cyanoethyl]-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137211684
N-(1-cyanoethyl)-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137212797
N-[(1S)-1-cyanoethyl]-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137223449
1-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]cyclopropane-1-carboxamide;hydrochloride
CID 137239609
1-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]cyclopropane-1-carboxamide
CID 137239610
N-cyclobutyl-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137243238

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide (CID 137184745) is (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide is C[C@@H](N)C(=O)NCc1noc(=O)[nH]1.
What is the InChIKey of (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide?
The InChIKey is BPLOXHVICFMWAD-GSVOUGTGSA-N. The full InChI is InChI=1S/C6H10N4O3/c1-3(7)5(11)8-2-4-9-6(12)13-10-4/h3H,2,7H2,1H3,(H,8,11)(H,9,10,12)/t3-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide?
(2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide has a molecular weight of 186.17 g/mol, XLogP of -1.67, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(5-oxo-4H-1,2,4-oxadiazol-3-yl)methyl]propanamide is sourced from PubChem (CID 137184745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).