(E,2R)-2-aminohex-4-en-1-ol

C6H13NO — CID 11344006

IUPAC(E,2R)-2-aminohex-4-en-1-ol
SMILESC/C=C/C[C@@H](N)CO
InChIInChI=1S/C6H13NO/c1-2-3-4-6(7)5-8/h2-3,6,8H,4-5,7H2,1H3/b3-2+/t6-/m1/s1
InChIKeyZEODUDKXIGPAIV-YRFDSLTASA-N
MW115.18 g/mol
LogP0.27
Rot. Bonds3

About (E,2R)-2-aminohex-4-en-1-ol

(E,2R)-2-aminohex-4-en-1-ol (PubChem CID 11344006) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is (E,2R)-2-aminohex-4-en-1-ol.

Molecular Properties

Compound Name(E,2R)-2-aminohex-4-en-1-ol
PubChem CID11344006
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name(E,2R)-2-aminohex-4-en-1-ol
SMILESC/C=C/C[C@@H](N)CO
InChIInChI=1S/C6H13NO/c1-2-3-4-6(7)5-8/h2-3,6,8H,4-5,7H2,1H3/b3-2+/t6-/m1/s1
InChIKeyZEODUDKXIGPAIV-YRFDSLTASA-N
XLogP0.27
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-amino-6-methylhept-4-en-1-ol
CID 55254356
2-amino-5-methylhex-4-en-1-ol
CID 55254047
(E,2R)-2-aminododec-4-en-1-ol
CID 139552020
(Z,2S)-2-ethylhex-4-en-1-ol
CID 89381426
(Z,2S)-2-aminohex-4-enoic acid
CID 91998876
(E)-3-aminooct-6-en-4-ol
CID 20676249
(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol
CID 141460109
(5Z)-2-fluorohepta-1,5-dien-3-amine
CID 89153786
(Z)-1-aminohex-4-en-2-ol
CID 155394876
1-sulfanylpent-3-en-1-ol
CID 91592280
1-chloropent-3-en-1-ol
CID 154207104
(E,2S)-2-aminopent-3-en-1-ol
CID 55283755

Frequently Asked Questions

What is the IUPAC name of (E,2R)-2-aminohex-4-en-1-ol?
The IUPAC name of (E,2R)-2-aminohex-4-en-1-ol (CID 11344006) is (E,2R)-2-aminohex-4-en-1-ol.
What is the SMILES notation for (E,2R)-2-aminohex-4-en-1-ol?
The canonical SMILES for (E,2R)-2-aminohex-4-en-1-ol is C/C=C/C[C@@H](N)CO.
What is the InChIKey of (E,2R)-2-aminohex-4-en-1-ol?
The InChIKey is ZEODUDKXIGPAIV-YRFDSLTASA-N. The full InChI is InChI=1S/C6H13NO/c1-2-3-4-6(7)5-8/h2-3,6,8H,4-5,7H2,1H3/b3-2+/t6-/m1/s1.
What are the key properties of (E,2R)-2-aminohex-4-en-1-ol?
(E,2R)-2-aminohex-4-en-1-ol has a molecular weight of 115.18 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E,2R)-2-aminohex-4-en-1-ol is sourced from PubChem (CID 11344006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).