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

C6H10N4O2 — CID 68733617

IUPAC(2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCc1nnc(NC(=O)[C@H](C)N)o1
InChIInChI=1S/C6H10N4O2/c1-3(7)5(11)8-6-10-9-4(2)12-6/h3H,7H2,1-2H3,(H,8,10,11)/t3-/m0/s1
InChIKeyNANNBLMJEJSVDN-VKHMYHEASA-N
MW170.17 g/mol
LogP-0.34
Rot. Bonds2

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

(2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 68733617) has the molecular formula C6H10N4O2 and a molecular weight of 170.17 g/mol. Its IUPAC name is (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID68733617
Molecular FormulaC6H10N4O2
Molecular Weight170.17 g/mol
Exact Mass170.08
IUPAC Name(2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCc1nnc(NC(=O)[C@H](C)N)o1
InChIInChI=1S/C6H10N4O2/c1-3(7)5(11)8-6-10-9-4(2)12-6/h3H,7H2,1-2H3,(H,8,10,11)/t3-/m0/s1
InChIKeyNANNBLMJEJSVDN-VKHMYHEASA-N
XLogP-0.34
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide (CID 68733617) is (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide is Cc1nnc(NC(=O)[C@H](C)N)o1.
What is the InChIKey of (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is NANNBLMJEJSVDN-VKHMYHEASA-N. The full InChI is InChI=1S/C6H10N4O2/c1-3(7)5(11)8-6-10-9-4(2)12-6/h3H,7H2,1-2H3,(H,8,10,11)/t3-/m0/s1.
What are the key properties of (2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
(2S)-2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 170.17 g/mol, XLogP of -0.34, 2 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-methyl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 68733617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).