(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide

C11H21NO — CID 89027840

IUPAC(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide
SMILESC/C(=C/C(=O)NC(C)(C)C)C(C)C
InChIInChI=1S/C11H21NO/c1-8(2)9(3)7-10(13)12-11(4,5)6/h7-8H,1-6H3,(H,12,13)/b9-7-
InChIKeyXEVGZVPTBIQDLJ-CLFYSBASSA-N
MW183.29 g/mol
LogP2.50
Rot. Bonds2

About (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide

(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide (PubChem CID 89027840) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide.

Molecular Properties

Compound Name(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide
PubChem CID89027840
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide
SMILESC/C(=C/C(=O)NC(C)(C)C)C(C)C
InChIInChI=1S/C11H21NO/c1-8(2)9(3)7-10(13)12-11(4,5)6/h7-8H,1-6H3,(H,12,13)/b9-7-
InChIKeyXEVGZVPTBIQDLJ-CLFYSBASSA-N
XLogP2.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.50
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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Related Compounds

(Z)-N-(tert-butyl)-3-ethyl-4-fluoropent-2-enamide
CID 177897438
(E)-N-tert-butyl-3-cyclopropyl-4,4,4-trifluorobut-2-enamide
CID 70848146
(Z)-N-tert-butyl-4-methyl-3-(trifluoromethyl)pent-2-enamide
CID 89027815
(E)-N-tert-butyl-4-methyl-3-(trifluoromethyl)pent-2-enamide
CID 89037517
4,5,5-trimethyl-1H-pyrrol-2-one
CID 12560817
N-tert-butyl-3-methylbut-2-enamide
CID 15544417
N-tert-butyl-4-methylhexa-2,3-dienamide
CID 85812444
(E)-N-tert-butyl-5,5-dimethyl-4-methylidenehex-2-enamide
CID 102084152
(2E)-N-tert-butyl-4-methylpenta-2,4-dienamide
CID 131234353
(E)-N-tert-butyl-5-methyl-4-methylidenehex-2-enamide
CID 135056552
(E)-N-tert-butyl-5-methylhex-2-enamide
CID 135080469
2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide
CID 130718770

Frequently Asked Questions

What is the IUPAC name of (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide?
The IUPAC name of (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide (CID 89027840) is (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide.
What is the SMILES notation for (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide?
The canonical SMILES for (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide is C/C(=C/C(=O)NC(C)(C)C)C(C)C.
What is the InChIKey of (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide?
The InChIKey is XEVGZVPTBIQDLJ-CLFYSBASSA-N. The full InChI is InChI=1S/C11H21NO/c1-8(2)9(3)7-10(13)12-11(4,5)6/h7-8H,1-6H3,(H,12,13)/b9-7-.
What are the key properties of (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide?
(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide has a molecular weight of 183.29 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-tert-butyl-3,4-dimethylpent-2-enamide is sourced from PubChem (CID 89027840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).