(Z)-2,3-dimethylhex-2-enamide

C8H15NO — CID 87282568

IUPAC(Z)-2,3-dimethylhex-2-enamide
SMILESCCC/C(C)=C(/C)C(N)=O
InChIInChI=1S/C8H15NO/c1-4-5-6(2)7(3)8(9)10/h4-5H2,1-3H3,(H2,9,10)/b7-6-
InChIKeyCNIURQPMVHPWQG-SREVYHEPSA-N
MW141.21 g/mol
LogP1.61
Rot. Bonds3

About (Z)-2,3-dimethylhex-2-enamide

(Z)-2,3-dimethylhex-2-enamide (PubChem CID 87282568) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (Z)-2,3-dimethylhex-2-enamide.

Molecular Properties

Compound Name(Z)-2,3-dimethylhex-2-enamide
PubChem CID87282568
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(Z)-2,3-dimethylhex-2-enamide
SMILESCCC/C(C)=C(/C)C(N)=O
InChIInChI=1S/C8H15NO/c1-4-5-6(2)7(3)8(9)10/h4-5H2,1-3H3,(H2,9,10)/b7-6-
InChIKeyCNIURQPMVHPWQG-SREVYHEPSA-N
XLogP1.61
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2,3-dimethylhex-2-enamide?
The IUPAC name of (Z)-2,3-dimethylhex-2-enamide (CID 87282568) is (Z)-2,3-dimethylhex-2-enamide.
What is the SMILES notation for (Z)-2,3-dimethylhex-2-enamide?
The canonical SMILES for (Z)-2,3-dimethylhex-2-enamide is CCC/C(C)=C(/C)C(N)=O.
What is the InChIKey of (Z)-2,3-dimethylhex-2-enamide?
The InChIKey is CNIURQPMVHPWQG-SREVYHEPSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-5-6(2)7(3)8(9)10/h4-5H2,1-3H3,(H2,9,10)/b7-6-.
What are the key properties of (Z)-2,3-dimethylhex-2-enamide?
(Z)-2,3-dimethylhex-2-enamide has a molecular weight of 141.21 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,3-dimethylhex-2-enamide is sourced from PubChem (CID 87282568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).