(2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide

C8H12N4O2 — CID 61252132

IUPAC(2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide
SMILESC[C@H](N)C(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C8H12N4O2/c1-4(9)6(13)10-8-12-11-7(14-8)5-2-3-5/h4-5H,2-3,9H2,1H3,(H,10,12,13)/t4-/m0/s1
InChIKeyREZGHSDUNUNNQI-BYPYZUCNSA-N
MW196.21 g/mol
LogP0.23
Rot. Bonds3

About (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide

(2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 61252132) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID61252132
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name(2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide
SMILESC[C@H](N)C(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C8H12N4O2/c1-4(9)6(13)10-8-12-11-7(14-8)5-2-3-5/h4-5H,2-3,9H2,1H3,(H,10,12,13)/t4-/m0/s1
InChIKeyREZGHSDUNUNNQI-BYPYZUCNSA-N
XLogP0.23
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Acetamide, 2-(dimethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)-
CID 3073224
Acetamide, 2-(dipropylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)-
CID 3073230
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79261615
2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3,3,3-trifluoro-2-methylpropanamide
CID 79805717
(2R,4S)-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-4-fluoropyrrolidine-2-carboxamide
CID 172371447
N-(5-ethyl-1,3,4-oxadiazol-2-yl)cyclopropanecarboxamide
CID 19029555
N-{5-[(1S)-1-amino-2,2-dimethylpropyl]-1,3,4-oxadiazol-2-yl}cyclopropane-carboxamide hydrochloride
CID 66949762
N-[5-[(1S)-1-amino-2,2-dimethylpropyl]-1,3,4-oxadiazol-2-yl]cyclopropanecarboxamide
CID 66949763
(2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 68733617
N-[5-(1-amino-2,2-dimethylpropyl)-1,3,4-oxadiazol-2-yl]cyclopropanecarboxamide
CID 70969126
N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine
CID 83873657
N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen
CID 169163463

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide (CID 61252132) is (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide is C[C@H](N)C(=O)Nc1nnc(C2CC2)o1.
What is the InChIKey of (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is REZGHSDUNUNNQI-BYPYZUCNSA-N. The full InChI is InChI=1S/C8H12N4O2/c1-4(9)6(13)10-8-12-11-7(14-8)5-2-3-5/h4-5H,2-3,9H2,1H3,(H,10,12,13)/t4-/m0/s1.
What are the key properties of (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide?
(2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 196.21 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 61252132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).