(2R)-2-amino-6-hydroxyhexanoic acid

C6H13NO3 — CID 5288041

IUPAC(2R)-2-amino-6-hydroxyhexanoic acid
SMILESN[C@H](CCCCO)C(=O)O
InChIInChI=1S/C6H13NO3/c7-5(6(9)10)3-1-2-4-8/h5,8H,1-4,7H2,(H,9,10)/t5-/m1/s1
InChIKeyOLUWXTFAPJJWPL-RXMQYKEDSA-N
MW147.17 g/mol
LogP-0.44
Rot. Bonds5

About (2R)-2-amino-6-hydroxyhexanoic acid

(2R)-2-amino-6-hydroxyhexanoic acid (PubChem CID 5288041) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is (2R)-2-amino-6-hydroxyhexanoic acid.

Molecular Properties

Compound Name(2R)-2-amino-6-hydroxyhexanoic acid
PubChem CID5288041
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name(2R)-2-amino-6-hydroxyhexanoic acid
SMILESN[C@H](CCCCO)C(=O)O
InChIInChI=1S/C6H13NO3/c7-5(6(9)10)3-1-2-4-8/h5,8H,1-4,7H2,(H,9,10)/t5-/m1/s1
InChIKeyOLUWXTFAPJJWPL-RXMQYKEDSA-N
XLogP-0.44
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S,7S)-2,7-diaminooctanedioic acid
CID 7033159
(2R,8R)-2,8-diaminononanedioic acid
CID 6994849
2,6-diaminoheptanedioic acid
CID 865
2,5-diaminopentanoic acid;ethane-1,2-diol
CID 174654889
2,6-diamino(1,2,3,4,5,6-13C6)hexanoic acid
CID 155890004
2,10,10-triaminodecanoic acid
CID 141091504
(2S,7S)-2-amino-7,8-dihydroxyoctanoic acid
CID 177277676
2-amino-6-(15N)azanylhexanoic acid;dihydrochloride
CID 45157533
(2S)-2,6-diaminohexanoic acid;gold
CID 174858889
2,6-diaminohexanoic acid;titanium
CID 174642581
2,6-diaminohexanoic acid;2,5-diaminopentanoic acid
CID 18793360
(2S)-2,7-diamino-7-oxoheptanoic acid
CID 88911267

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-6-hydroxyhexanoic acid?
The IUPAC name of (2R)-2-amino-6-hydroxyhexanoic acid (CID 5288041) is (2R)-2-amino-6-hydroxyhexanoic acid.
What is the SMILES notation for (2R)-2-amino-6-hydroxyhexanoic acid?
The canonical SMILES for (2R)-2-amino-6-hydroxyhexanoic acid is N[C@H](CCCCO)C(=O)O.
What is the InChIKey of (2R)-2-amino-6-hydroxyhexanoic acid?
The InChIKey is OLUWXTFAPJJWPL-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H13NO3/c7-5(6(9)10)3-1-2-4-8/h5,8H,1-4,7H2,(H,9,10)/t5-/m1/s1.
What are the key properties of (2R)-2-amino-6-hydroxyhexanoic acid?
(2R)-2-amino-6-hydroxyhexanoic acid has a molecular weight of 147.17 g/mol, XLogP of -0.44, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-6-hydroxyhexanoic acid is sourced from PubChem (CID 5288041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).