(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide

C8H14N4O2 — CID 106397573

IUPAC(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
SMILESCC[C@@H](N)C(=O)NCCc1ncno1
InChIInChI=1S/C8H14N4O2/c1-2-6(9)8(13)10-4-3-7-11-5-12-14-7/h5-6H,2-4,9H2,1H3,(H,10,13)/t6-/m1/s1
InChIKeyGBXXILXUHCTMBN-ZCFIWIBFSA-N
MW198.23 g/mol
LogP-0.53
Rot. Bonds5

About (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide

(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide (PubChem CID 106397573) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
PubChem CID106397573
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
SMILESCC[C@@H](N)C(=O)NCCc1ncno1
InChIInChI=1S/C8H14N4O2/c1-2-6(9)8(13)10-4-3-7-11-5-12-14-7/h5-6H,2-4,9H2,1H3,(H,10,13)/t6-/m1/s1
InChIKeyGBXXILXUHCTMBN-ZCFIWIBFSA-N
XLogP-0.53
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-3-phenylpropanamide
CID 106397552
4-amino-2-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 106397296
3-amino-5,5-dimethyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]hexanamide
CID 114183576
3-amino-4-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pentanamide
CID 106397303
1-methyl-3-[2-(1,2,4-oxadiazol-5-yl)ethyl]urea
CID 103743952
3-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-phenylpropanamide
CID 106397456
3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-3-oxopropanoic acid
CID 104889379
2-carbamothioyl-2-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 106399310
N-(ethylcarbamoyl)-2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]propanamide
CID 106399971
(2S)-2-amino-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]butanamide
CID 79023094
2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide
CID 106397273
4-amino-1-ethyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyrrole-2-carboxamide
CID 114182801

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide?
The IUPAC name of (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide (CID 106397573) is (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide is CC[C@@H](N)C(=O)NCCc1ncno1.
What is the InChIKey of (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide?
The InChIKey is GBXXILXUHCTMBN-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-2-6(9)8(13)10-4-3-7-11-5-12-14-7/h5-6H,2-4,9H2,1H3,(H,10,13)/t6-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide?
(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide has a molecular weight of 198.23 g/mol, XLogP of -0.53, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide is sourced from PubChem (CID 106397573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).