(2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid

C10H19NO3 — CID 18639738

IUPAC(2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid
SMILESN[C@@](O)(CCC1CCCCC1)C(=O)O
InChIInChI=1S/C10H19NO3/c11-10(14,9(12)13)7-6-8-4-2-1-3-5-8/h8,14H,1-7,11H2,(H,12,13)/t10-/m1/s1
InChIKeyWYTVONIMXWUQKR-SNVBAGLBSA-N
MW201.27 g/mol
LogP1.08
Rot. Bonds4

About (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid

(2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid (PubChem CID 18639738) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid.

Molecular Properties

Compound Name(2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid
PubChem CID18639738
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name(2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid
SMILESN[C@@](O)(CCC1CCCCC1)C(=O)O
InChIInChI=1S/C10H19NO3/c11-10(14,9(12)13)7-6-8-4-2-1-3-5-8/h8,14H,1-7,11H2,(H,12,13)/t10-/m1/s1
InChIKeyWYTVONIMXWUQKR-SNVBAGLBSA-N
XLogP1.08
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-cyclobutyl-2-hydroxybutanamide
CID 154309484
(2S)-2-amino-2-cyclohexyl-2-cyclopentylacetic acid
CID 67022454
calcium;3-cyclopentylpropanoic acid;hydride
CID 173013179
carbonic acid;cyclohexylmethanamine
CID 67545146
2-(cyclohexylmethyl)-2-ethoxycarbonylpentanoic acid
CID 103974066
4-cyclohexylbutanoic acid;λ2-plumbane
CID 173062750
4-cyclohexyl-2-oxobutanamide
CID 69253318
2-cyclohexylethyl carbonochloridate
CID 19994353
CID 131865884
CID 131865884
1-cyclohexyl-3-methylpentan-3-amine
CID 67766533
2-amino-4-cyclohexylbutanoic acid;2,2,2-trifluoroacetic acid
CID 70021920
(2S,3S)-2-amino-3-(cyclohexylmethyl)-2-hydroxy-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
CID 154154666

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid?
The IUPAC name of (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid (CID 18639738) is (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid.
What is the SMILES notation for (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid?
The canonical SMILES for (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid is N[C@@](O)(CCC1CCCCC1)C(=O)O.
What is the InChIKey of (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid?
The InChIKey is WYTVONIMXWUQKR-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H19NO3/c11-10(14,9(12)13)7-6-8-4-2-1-3-5-8/h8,14H,1-7,11H2,(H,12,13)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid?
(2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid has a molecular weight of 201.27 g/mol, XLogP of 1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-cyclohexyl-2-hydroxybutanoic acid is sourced from PubChem (CID 18639738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).