(2S,3R)-azetidine-2,3-dicarboxamide

C5H9N3O2 — CID 54049662

IUPAC(2S,3R)-azetidine-2,3-dicarboxamide
SMILESNC(=O)[C@H]1NC[C@H]1C(N)=O
InChIInChI=1S/C5H9N3O2/c6-4(9)2-1-8-3(2)5(7)10/h2-3,8H,1H2,(H2,6,9)(H2,7,10)/t2-,3+/m1/s1
InChIKeyLRZOZORYWPASTQ-GBXIJSLDSA-N
MW143.15 g/mol
LogP-2.45
Rot. Bonds2

About (2S,3R)-azetidine-2,3-dicarboxamide

(2S,3R)-azetidine-2,3-dicarboxamide (PubChem CID 54049662) has the molecular formula C5H9N3O2 and a molecular weight of 143.15 g/mol. Its IUPAC name is (2S,3R)-azetidine-2,3-dicarboxamide.

Molecular Properties

Compound Name(2S,3R)-azetidine-2,3-dicarboxamide
PubChem CID54049662
Molecular FormulaC5H9N3O2
Molecular Weight143.15 g/mol
Exact Mass143.07
IUPAC Name(2S,3R)-azetidine-2,3-dicarboxamide
SMILESNC(=O)[C@H]1NC[C@H]1C(N)=O
InChIInChI=1S/C5H9N3O2/c6-4(9)2-1-8-3(2)5(7)10/h2-3,8H,1H2,(H2,6,9)(H2,7,10)/t2-,3+/m1/s1
InChIKeyLRZOZORYWPASTQ-GBXIJSLDSA-N
XLogP-2.45
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-2.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethylpiperidine-2-carboxamide
CID 173167928
(1S,4S)-2,5-diazabicyclo[2.2.1]heptane-3-carboxamide;hydrochloride
CID 141284122
trans-(1R,2R)-2-aminocyclopropane-1-carboxamide
CID 89465194
3-aminoazetidine-2-carboxylic acid
CID 23504294
4-hydroxypiperidine-3-carboxamide
CID 146446982
2-sulfanylcyclopropane-1-carboxamide
CID 123387138
cis-(1R,2R)-2-fluorocyclopropane-1-carboxamide
CID 119095885
2-azabicyclo[2.2.2]octane-3-carboxamide
CID 19876032
trans-(1S,2S)-2-aminocyclobutane-1-carboxamide
CID 97301417
cis-(1R,2S)-2-carbamoylcyclopropane-1-carboxylic acid
CID 93311791
trans-(1R,2R)-2-carbamoylcyclopropane-1-carboxylic acid
CID 13039560
(2R,4R)-4-aminopyrrolidine-2-carboxamide
CID 58079537

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-azetidine-2,3-dicarboxamide?
The IUPAC name of (2S,3R)-azetidine-2,3-dicarboxamide (CID 54049662) is (2S,3R)-azetidine-2,3-dicarboxamide.
What is the SMILES notation for (2S,3R)-azetidine-2,3-dicarboxamide?
The canonical SMILES for (2S,3R)-azetidine-2,3-dicarboxamide is NC(=O)[C@H]1NC[C@H]1C(N)=O.
What is the InChIKey of (2S,3R)-azetidine-2,3-dicarboxamide?
The InChIKey is LRZOZORYWPASTQ-GBXIJSLDSA-N. The full InChI is InChI=1S/C5H9N3O2/c6-4(9)2-1-8-3(2)5(7)10/h2-3,8H,1H2,(H2,6,9)(H2,7,10)/t2-,3+/m1/s1.
What are the key properties of (2S,3R)-azetidine-2,3-dicarboxamide?
(2S,3R)-azetidine-2,3-dicarboxamide has a molecular weight of 143.15 g/mol, XLogP of -2.45, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-azetidine-2,3-dicarboxamide is sourced from PubChem (CID 54049662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).