(2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid

C9H15NO4 — CID 107823219

IUPAC(2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid
SMILESO=C(N[C@H](CCO)C(=O)O)C1CCC1
InChIInChI=1S/C9H15NO4/c11-5-4-7(9(13)14)10-8(12)6-2-1-3-6/h6-7,11H,1-5H2,(H,10,12)(H,13,14)/t7-/m1/s1
InChIKeyRFCICKALZQSBNJ-SSDOTTSWSA-N
MW201.22 g/mol
LogP-0.26
Rot. Bonds5

About (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid

(2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid (PubChem CID 107823219) has the molecular formula C9H15NO4 and a molecular weight of 201.22 g/mol. Its IUPAC name is (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid.

Molecular Properties

Compound Name(2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid
PubChem CID107823219
Molecular FormulaC9H15NO4
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC Name(2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid
SMILESO=C(N[C@H](CCO)C(=O)O)C1CCC1
InChIInChI=1S/C9H15NO4/c11-5-4-7(9(13)14)10-8(12)6-2-1-3-6/h6-7,11H,1-5H2,(H,10,12)(H,13,14)/t7-/m1/s1
InChIKeyRFCICKALZQSBNJ-SSDOTTSWSA-N
XLogP-0.26
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclobutanecarbonylamino)pentanedioic acid
CID 60657073
(2S)-4-hydroxy-2-[[(3S)-piperidine-3-carbonyl]amino]butanoic acid
CID 107824929
(2R)-2-[(1-carbamoylpiperidine-3-carbonyl)amino]-4-hydroxybutanoic acid
CID 114005009
(2S)-2-(bicyclo[4.1.0]heptane-7-carbonylamino)-4-hydroxybutanoic acid
CID 107822655
(2R)-4-hydroxy-2-(oxolane-3-carbonylamino)butanoic acid
CID 107823475
(2R)-4-hydroxy-2-(pyrrolidine-3-carbonylamino)butanoic acid
CID 107825270
4-hydroxy-2-[(1-methylsulfonylpiperidine-3-carbonyl)amino]butanoic acid
CID 61244034
(2R)-2-(cyclooctanecarbonylamino)hexanedioic acid
CID 107831603
2-[[1-(dimethylcarbamoyl)piperidine-3-carbonyl]amino]-4-hydroxybutanoic acid
CID 61243104
(2R)-2-[[1-(dimethylcarbamoyl)piperidine-4-carbonyl]amino]-4-hydroxybutanoic acid
CID 107823552
(2S)-2-[(2-cyclobutylacetyl)amino]-4-hydroxybutanoic acid
CID 107822267
2-[(2-cyclobutylacetyl)amino]-4-hydroxybutanoic acid
CID 103161841

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid?
The IUPAC name of (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid (CID 107823219) is (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid.
What is the SMILES notation for (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid?
The canonical SMILES for (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid is O=C(N[C@H](CCO)C(=O)O)C1CCC1.
What is the InChIKey of (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid?
The InChIKey is RFCICKALZQSBNJ-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H15NO4/c11-5-4-7(9(13)14)10-8(12)6-2-1-3-6/h6-7,11H,1-5H2,(H,10,12)(H,13,14)/t7-/m1/s1.
What are the key properties of (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid?
(2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid has a molecular weight of 201.22 g/mol, XLogP of -0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(cyclobutanecarbonylamino)-4-hydroxybutanoic acid is sourced from PubChem (CID 107823219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).