(2R)-2-aminobutanediamide

C4H9N3O2 — CID 11636805

IUPAC(2R)-2-aminobutanediamide
SMILESNC(=O)C[C@@H](N)C(N)=O
InChIInChI=1S/C4H9N3O2/c5-2(4(7)9)1-3(6)8/h2H,1,5H2,(H2,6,8)(H2,7,9)/t2-/m1/s1
InChIKeyDSLBDPPHINVUID-UWTATZPHSA-N
MW131.13 g/mol
LogP-2.33
Rot. Bonds3

About (2R)-2-aminobutanediamide

(2R)-2-aminobutanediamide (PubChem CID 11636805) has the molecular formula C4H9N3O2 and a molecular weight of 131.13 g/mol. Its IUPAC name is (2R)-2-aminobutanediamide.

Molecular Properties

Compound Name(2R)-2-aminobutanediamide
PubChem CID11636805
Molecular FormulaC4H9N3O2
Molecular Weight131.13 g/mol
Exact Mass131.07
IUPAC Name(2R)-2-aminobutanediamide
SMILESNC(=O)C[C@@H](N)C(N)=O
InChIInChI=1S/C4H9N3O2/c5-2(4(7)9)1-3(6)8/h2H,1,5H2,(H2,6,8)(H2,7,9)/t2-/m1/s1
InChIKeyDSLBDPPHINVUID-UWTATZPHSA-N
XLogP-2.33
TPSA112.20 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.13
LogP ≤ 5-2.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-aminobutanediamide?
The IUPAC name of (2R)-2-aminobutanediamide (CID 11636805) is (2R)-2-aminobutanediamide.
What is the SMILES notation for (2R)-2-aminobutanediamide?
The canonical SMILES for (2R)-2-aminobutanediamide is NC(=O)C[C@@H](N)C(N)=O.
What is the InChIKey of (2R)-2-aminobutanediamide?
The InChIKey is DSLBDPPHINVUID-UWTATZPHSA-N. The full InChI is InChI=1S/C4H9N3O2/c5-2(4(7)9)1-3(6)8/h2H,1,5H2,(H2,6,8)(H2,7,9)/t2-/m1/s1.
What are the key properties of (2R)-2-aminobutanediamide?
(2R)-2-aminobutanediamide has a molecular weight of 131.13 g/mol, XLogP of -2.33, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-aminobutanediamide is sourced from PubChem (CID 11636805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).