(E)-2,3,3,4-tetramethylhex-4-enamide

C10H19NO — CID 145224593

IUPAC(E)-2,3,3,4-tetramethylhex-4-enamide
SMILESC/C=C(\C)C(C)(C)C(C)C(N)=O
InChIInChI=1S/C10H19NO/c1-6-7(2)10(4,5)8(3)9(11)12/h6,8H,1-5H3,(H2,11,12)/b7-6+
InChIKeyLQGOVPYUNYEWBT-VOTSOKGWSA-N
MW169.27 g/mol
LogP2.10
Rot. Bonds3

About (E)-2,3,3,4-tetramethylhex-4-enamide

(E)-2,3,3,4-tetramethylhex-4-enamide (PubChem CID 145224593) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (E)-2,3,3,4-tetramethylhex-4-enamide.

Molecular Properties

Compound Name(E)-2,3,3,4-tetramethylhex-4-enamide
PubChem CID145224593
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(E)-2,3,3,4-tetramethylhex-4-enamide
SMILESC/C=C(\C)C(C)(C)C(C)C(N)=O
InChIInChI=1S/C10H19NO/c1-6-7(2)10(4,5)8(3)9(11)12/h6,8H,1-5H3,(H2,11,12)/b7-6+
InChIKeyLQGOVPYUNYEWBT-VOTSOKGWSA-N
XLogP2.10
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(2R)-2,3,3-trimethylbutanamide;(2S)-2,3,3-trimethylbutanamide
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2,3,3,4,4-pentamethylpentanamide
CID 123826668
2,3,3,4-tetramethylhexanamide
CID 90191700
4-hydroxy-2,3,3-trimethylbutanamide
CID 55284516
(Z)-5,5,6-trimethylhept-2-en-4-one
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2-methylpropanamide;bis(propan-2-one)
CID 174404145
8,8,9-trimethyldeca-3,5-diene-2,7-dione
CID 540322
carbamic acid;2,2-difluoro-3-methylbutane
CID 161455862
(3R)-3-amino-2,2-dimethylbutanamide
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(Z)-2,4,4-trimethylhept-5-enamide
CID 144603473

Frequently Asked Questions

What is the IUPAC name of (E)-2,3,3,4-tetramethylhex-4-enamide?
The IUPAC name of (E)-2,3,3,4-tetramethylhex-4-enamide (CID 145224593) is (E)-2,3,3,4-tetramethylhex-4-enamide.
What is the SMILES notation for (E)-2,3,3,4-tetramethylhex-4-enamide?
The canonical SMILES for (E)-2,3,3,4-tetramethylhex-4-enamide is C/C=C(\C)C(C)(C)C(C)C(N)=O.
What is the InChIKey of (E)-2,3,3,4-tetramethylhex-4-enamide?
The InChIKey is LQGOVPYUNYEWBT-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H19NO/c1-6-7(2)10(4,5)8(3)9(11)12/h6,8H,1-5H3,(H2,11,12)/b7-6+.
What are the key properties of (E)-2,3,3,4-tetramethylhex-4-enamide?
(E)-2,3,3,4-tetramethylhex-4-enamide has a molecular weight of 169.27 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,3,3,4-tetramethylhex-4-enamide is sourced from PubChem (CID 145224593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).