(2R)-2-hydroxy-N-prop-2-enylpent-4-enamide

C8H13NO2 — CID 11217373

IUPAC(2R)-2-hydroxy-N-prop-2-enylpent-4-enamide
SMILESC=CCNC(=O)[C@H](O)CC=C
InChIInChI=1S/C8H13NO2/c1-3-5-7(10)8(11)9-6-4-2/h3-4,7,10H,1-2,5-6H2,(H,9,11)/t7-/m1/s1
InChIKeyAMQSYTPUXGSBHY-SSDOTTSWSA-N
MW155.20 g/mol
LogP0.23
Rot. Bonds5

About (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide

(2R)-2-hydroxy-N-prop-2-enylpent-4-enamide (PubChem CID 11217373) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-N-prop-2-enylpent-4-enamide
PubChem CID11217373
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name(2R)-2-hydroxy-N-prop-2-enylpent-4-enamide
SMILESC=CCNC(=O)[C@H](O)CC=C
InChIInChI=1S/C8H13NO2/c1-3-5-7(10)8(11)9-6-4-2/h3-4,7,10H,1-2,5-6H2,(H,9,11)/t7-/m1/s1
InChIKeyAMQSYTPUXGSBHY-SSDOTTSWSA-N
XLogP0.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide?
The IUPAC name of (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide (CID 11217373) is (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide.
What is the SMILES notation for (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide?
The canonical SMILES for (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide is C=CCNC(=O)[C@H](O)CC=C.
What is the InChIKey of (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide?
The InChIKey is AMQSYTPUXGSBHY-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H13NO2/c1-3-5-7(10)8(11)9-6-4-2/h3-4,7,10H,1-2,5-6H2,(H,9,11)/t7-/m1/s1.
What are the key properties of (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide?
(2R)-2-hydroxy-N-prop-2-enylpent-4-enamide has a molecular weight of 155.20 g/mol, XLogP of 0.23, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-N-prop-2-enylpent-4-enamide is sourced from PubChem (CID 11217373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).